SCHEMBL9799597

SCHEMBL9799597

C=CC/C(C(=O)O)=C(\O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
ABCC4 O15439 1/20 0.34
LMNA P02545 1/20 0.32
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8664476 1.00 MAPT (0.34) MAPTABCC4LMNAALDH1A1ALOX15
SCHEMBL815175 0.86 LMNA (0.37) MAPTABCC4LMNAALDH1A1ALOX15
SCHEMBL3903875 0.86 LMNA (0.37) MAPTABCC4LMNAALDH1A1ALOX15
SCHEMBL815174 0.86 LMNA (0.37) MAPTABCC4LMNAALDH1A1ALOX15
SCHEMBL4758053 0.81 LMNA (0.33) MAPTABCC4LMNAALDH1A1ALOX15
SCHEMBL28253629 0.80
SCHEMBL729718 0.79 LMNA (0.32) MAPTABCC4LMNAALOX15HSD17B10
SCHEMBL211112 0.79 LMNA (0.32) MAPTABCC4LMNAALOX15HSD17B10
SCHEMBL8570759 0.77 ALDH1A1 (0.35) LMNAALDH1A1TSHR
SCHEMBL14735866 0.77 GABRR1 (0.31) LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3235842-B2 SELF-REPAIRING POLYURETHANE RESIN MATERIAL, SELF-REPAIRING POLYURETHANE RESIN, SELF-REPAIRING COATING MATERIAL, SELF-REPAIRING ELASTOMER MATERIAL, METHOD FOR PRODUCING SELF-REPAIRING POLYURETHANE RESIN MATERIAL, AND METHOD FOR PRODUCING SELF-REPAIRING POLYURETHANE RESIN MITSUI CHEMICALS INC (JP) 2023-10-11 EP disclosed
WO-2023106258-A1 POLYMERIZABLE COMPOSITION FOR MANUFACTURING MOLDED ARTICLE, MOLDED ARTICLE AND MANUFACTURING METHOD THEREOF MITSUI CHEMICALS, INC. (JP) 2023-06-15 WO disclosed
EP-3345947-B1 SHOCK-ABSORBING MEMBER, SHOCK-ABSORBING MEMBER FOR AUTOMATIC MOVEMENT DEVICE FOR PAINTING, AUTOMATIC MOVEMENT DEVICE WITH SHOCK-ABSORBING MEMBER, AND AUTOMATIC MOVEMENT DEVICE FOR PAINTING WITH SHOCK-ABSORBING MEMBER MITSUI CHEMICALS INC (JP) 2022-07-06 EP disclosed
US-10913251-B2 Buffer material, buffer material for coating robot, robot with buffer material, and coating robot with buffer material MITSUI CHEMICALS, INC. (JP) 2021-02-09 US disclosed
EP-3235842-B1 SELF-REPAIRING POLYURETHANE RESIN MATERIAL, SELF-REPAIRING POLYURETHANE RESIN, SELF-REPAIRING COATING MATERIAL, SELF-REPAIRING ELASTOMER MATERIAL, METHOD FOR PRODUCING SELF-REPAIRING POLYURETHANE RESIN MATERIAL, AND METHOD FOR PRODUCING SELF-REPAIRING POLYURETHANE RESIN MITSUI CHEMICALS INC (JP) 2021-01-20 EP disclosed
EP-3115430-B1 LAMINATE ADHESIVE, METHOD FOR MANUFACTURING LAMINATE FILM, LAMINATE FILM, AND RETORT POUCH MATERIAL MITSUI CHEMICALS INC (JP) 2020-08-05 EP disclosed
EP-3168256-B1 EYEWEAR MATERIAL COMPRISING A POLYURETHANE RESIN, EYEWEAR FRAME AND LENS MITSUI CHEMICALS INC (JP) 2019-08-07 EP disclosed
EP-3486230-A1 PENTAMETHYLENEDIISOCYANATE, METHOD FOR PRODUCING PENTAMETHYLENEDIISOCYANATE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, AND POLYUREA RESIN Mitsui Chemicals, Inc. (JP) 2019-05-22 EP disclosed
EP-3037411-B1 1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, MOLDED ARTICLE, EYEWEAR MATERIAL, EYEWEAR FRAME AND LENS MITSUI CHEMICALS INC (JP) 2019-03-27 EP disclosed
EP-2684867-B1 PENTAMETHYLENE DIISOCYANATE, METHOD FOR PRODUCING PENTAMETHYLENE DIISOCYANATE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, AND POLYUREA RESIN MITSUI CHEMICALS INC (JP) 2019-01-02 EP disclosed
EP-2684867-A1 PENTAMETHYLENE DIISOCYANATE, METHOD FOR PRODUCING PENTAMETHYLENE DIISOCYANATE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, AND POLYUREA RESIN Mitsui Chemicals, Inc. (JP) 2014-01-15 EP disclosed
US-20130338330-A1 PENTAMETHYLENEDIISOCYANATE, METHOD FOR PRODUCING PENTAMETHYLENEDIISOCYANATE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, AND POLYUREA RESIN MITSUI CHEMICALS ,INC. 2013-12-19 US disclosed
US-20130079486-A1 METHOD FOR PRODUCING 1,5-PENTAMETHYLENEDIAMINE, 1,5-PENTAMETHYLENEDIAMINE, 1,5-PENTAMETHYLENE DIISOCYANATE, METHOD FOR PRODUCING 1,5-PENTAMETHYLENE DIISOCYANATE, POLYISOCYANATE COMPOSITION, AND POLYURETHANE RESIN MITSUI CHEMICALS, INC. (JP) 2013-03-28 US disclosed
EP-2543736-A1 METHOD FOR PRODUCING 1,5-PENTAMETHYLENE DIAMINE, 1,5-PENTAMETHYLENE DIAMINE, 1,5-PENTAMETHYLENE DIISOCYANATE, METHOD FOR PRODUCING 1,5-PENTAMETHYLENE DIISOCYANATE, POLYISOCYANATE COMPOSITION, AND POLYURETHANE RESIN Mitsui Chemicals, Inc. (JP) 2013-01-09 EP disclosed
EP-0140828-B1 CROSS-LINKED POROUS POLYMERS FOR CONTROLLED DRUG RELEASE CIBA-GEIGY AG (CH) 1991-02-27 EP disclosed
EP-0140828-A2 Cross-linked porous polymers for controlled drug release CIBA-GEIGY AG (CH) 1985-05-08 EP disclosed
EP-0019584-B1 OLIGOMERS WITH PERFLUOR ALKYL END GROUPS THAT CONTAIN MERCAPTO GROUPS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS SUFACE-ACTIVE SUBSTANCES AND AS ADDITIVES IN FIRE-EXTINGUISHING COMPOSITIONS CIBA-GEIGY AG (CH) 1984-11-14 EP disclosed
EP-0000507-B1 PROCESS FOR THE PRODUCTION OF HYDROGELS IN THE FORM OF SPHERICALLY SHAPED BEADS WITH LARGER DIAMETERS CIBA-GEIGY AG (CH) 1982-09-29 EP disclosed
EP-0019584-A2 Oligomers with perfluor alkyl end groups that contain mercapto groups, process for their preparation and their use as suface-active substances and as additives in fire-extinguishing compositions CIBA-GEIGY AG (CH) 1980-11-26 EP disclosed
EP-0000507-A1 Process for the production of hydrogels in the form of spherically shaped beads with larger diameters CIBA-GEIGY AG (CH) 1979-02-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130338330-A1 PENTAMETHYLENEDIISOCYANATE, METHOD FOR PRODUCING PENTAMETHYLENEDIISOCYANATE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, AND POLYUREA RESIN UROD, PUF60, PFAS MAPT 2301/4885ABCC4 3250/4885LMNA 3680/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.