SCHEMBL868776

SCHEMBL868776

CC=CC(=O)NCCCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.45
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
PTGS1 P23219 1/20 0.39
KCNH2 Q12809 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
ZDHHC20 Q5W0Z9 2/20 0.38
ZDHHC2 Q9UIJ5 2/20 0.38
CNR1 P21554 1/20 0.37
EGFR P00533 1/20 0.37
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
KDM4E B2RXH2 1/20 0.35
APP P05067 1/20 0.35

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
SCHEMBL21610956 0.89 APEX1 (0.49) APEX1ALDH1A1SMN1; SMN2TAAR1KMT2A
SCHEMBL4886401 0.86
SCHEMBL22187118 0.86 APEX1 (0.51) APEX1ALDH1A1SMN1; SMN2TAAR1MAPT
SCHEMBL5176320 0.86
SCHEMBL19696572 0.86
Hydrochloric Acid SCHEMBL27976199 0.84 SMN1; SMN2 (0.41) APEX1ALDH1A1SMN1; SMN2TAAR1KMT2A
SCHEMBL22187119 0.84 SMN1; SMN2 (0.46) APEX1ALDH1A1SMN1; SMN2TAAR1KMT2A
SCHEMBL14642043 0.84 SMN1; SMN2 (0.46) APEX1ALDH1A1SMN1; SMN2TAAR1KMT2A
SCHEMBL16908424 0.83 ALDH1A1 (0.59) APEX1ALDH1A1SMN1; SMN2TAAR1KMT2A
SCHEMBL3701815 0.83 ZDHHC20 (0.52) APEX1ALDH1A1MAPTZDHHC20ZDHHC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3529284-B1 HYDROPHILIC COPOLYMER WITH PENDANT THIOL GROUPS ALCON INC (CH) 2023-06-28 EP claimed
EP-3515993-B1 METHOD FOR PRODUCING A WATER-SOLUBLE THERMALLY-CROSSLINKABLE POLYMERIC MATERIAL ALCON INC (CH) 2021-11-10 EP claimed
US-10829574-B2 Hydrophilic copolymer with pendant thiol groups ALCON INC. (CH) 2020-11-10 US claimed
EP-3529288-B1 HYDROPHILIC COPOLYMER WITH ONE THIOL-CONTAINING TERMINAL GROUP ALCON INC (CH) 2020-09-02 EP claimed
US-20200199269-A1 HYDROPHILIC COPOLYMER WITH PENDANT THIOL GROUPS ALCON RESEARCH, LTD. 2020-06-25 US claimed
US-10618986-B2 Hydrophilic copolymer with pendant thiol groups ALCON INC. (CH) 2020-04-14 US claimed
US-20190317247-A1 EVALUATION METHOD FOR THE COVERAGE OF A COATING ON A CONTACT LENS SURFACE CIBA VISION GMBH (DE) 2019-10-17 US claimed
EP-3529284-A1 HYDROPHILIC COPOLYMER WITH PENDANT THIOL GROUPS Novartis AG (CH) 2019-08-28 EP claimed
EP-3529288-A1 HYDROPHILIC COPOLYMER WITH ONE THIOL-CONTAINING TERMINAL GROUP Novartis AG (CH) 2019-08-28 EP claimed
EP-3515993-A1 METHOD FOR PRODUCING A WATER-SOLUBLE THERMALLY-CROSSLINKABLE POLYMERIC MATERIAL Novartis AG (CH) 2019-07-31 EP claimed
US-20180079889-A1 METHOD FOR PRODUCING A WATER-SOLUBLE THERMALLY-CROSSLINKABLE POLYMERIC MATERIAL ALCON INC. (CH) 2018-03-22 US claimed
EP-2869363-B1 SEPARATOR, AND ELECTROCHEMICAL DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2017-04-26 EP claimed
US-20150349312-A1 SEPARATOR, METHOD FOR PRODUCING THE SAME AND ELECTROCHEMICAL DEVICE INCLUDING THE SAME LG ENERGY SOLUTION, LTD. (KR) 2015-12-03 US claimed
CN-103477491-B Barrier film, its manufacture method and comprise the electrochemical appliance of this barrier film LG CHEM, LTD. (KR) 2015-09-23 CN claimed
EP-2869363-A1 SEPARATOR, AND ELECTROCHEMICAL DEVICE COMPRISING SAME LG Chem, Ltd. (KR) 2015-05-06 EP claimed
US-9023505-B2 Separator and electrochemical device comprising the same LG CHEM, LTD. (KR) 2015-05-05 US claimed
US-20140186680-A1 SEPARATOR AND ELECTROCHEMICAL DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2014-07-03 US claimed
US-20140050965-A1 SEPARATOR, METHOD FOR PRODUCING THE SAME AND ELECTROCHEMICAL DEVICE INCLUDING THE SAME LG CHEM, LTD. (KR) 2014-02-20 US claimed
EP-2677590-A2 SEPARATOR, PREPARATION METHOD THEREOF, AND ELECTROCHEMICAL DEVICE COMPRISING SAME LG Chem, Ltd. (KR) 2013-12-25 EP claimed
CN-103477491-A Separator, preparation method thereof, and electrochemical device comprising same LG CHEMICAL LTD 2013-12-25 CN claimed

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-20180079889-A1 METHOD FOR PRODUCING A WATER-SOLUBLE THERMALLY-CROSSLINKABLE POLYMERIC MATERIAL INCENP, ILK, HSF1 APEX1 4503/4885ALDH1A1 3399/4885SMN1; SMN2 4235/4885

“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.