SCHEMBL898776

SCHEMBL898776

C=CCC(C(=C)C(=O)O)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.71
ALDH1A1 P00352 4/20 0.45
LMNA P02545 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MAPT P10636 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 1/20 0.41
EPHX1 P07099 1/20 0.40
HSD17B10 Q99714 2/20 0.36
CYP2D6 P10635 1/20 0.36
SRC P12931 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.35
CTSD P07339 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
SCHEMBL9577255 0.84 CYP2C19 (0.73) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL5371218 0.83 CYP2C19 (0.79) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL1458050 0.83 CYP2C19 (1.00) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL666893 0.83 CYP2C19 (1.00) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL1458057 0.83 CYP2C19 (1.00) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL1458161 0.81 CYP2C19 (0.96) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL6967261 0.81 CYP2C19 (0.76) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL1457969 0.81 CYP2C19 (0.96) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL10959538 0.81 CYP2C19 (0.96) CYP2C19ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL28501622 0.81 CYP2C19 (0.47) CYP2C19ALDH1A1SMN1; SMN2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655478-B1 PHOTOACTIVE POLYMER MATERIALS ROLIC AG (CH) 2017-06-14 EP claimed
EP-0860455-B1 Photocrosslinkable polymers ROLIC AG (CH) 2008-06-04 EP claimed
EP-0763552-B1 Curable, photoactive polymeric materials ROLIC AG (CH) 2001-09-19 EP claimed
EP-0860455-A2 Photocrosslinkable polymers Rolic AG (CH) 1998-08-26 EP claimed
EP-0763552-A2 Curable, photoactive polymeric materials Rolic AG (CH) 1997-03-19 EP claimed
EP-0324480-B1 Photopolymerizable compositions and elements for refractive index imaging DU PONT (US) 1994-04-13 EP claimed
US-12044872-B2 Method for generating alignment on top of a liquid crystal polymer material Rolic Technologies AG (CH) 2024-07-23 US disclosed
US-12012382-B2 Polymerizable liquid crystal having a carbazole core Rolic Technologies AG (CH) 2024-06-18 US disclosed
US-12006463-B2 Polymerizable liquid crystal having a quinoxaline-hydrazone core Rolic Technologies AG (CH) 2024-06-11 US disclosed
US-11952524-B2 Compositions of polymerizable liquid crystals Rolic Technologies AG (CH) 2024-04-09 US disclosed
EP-3990568-B1 NEW POLYMERIZABLE LIQUID CRYSTAL HAVING A QUINOXALINE-HYDRAZONE CORE ROLIC TECH AG (CH) 2023-11-15 EP disclosed
US-11702595-B2 Polymerizable liquid crystal Rolic Technologies AG (CH) 2023-07-18 US disclosed
EP-3126883-B1 OPTICAL DEVICES WITH PATTERNED ANISOTROPY INCORPORATING PARALLAX OPTIC ROLIC TECH AG (CH) 2023-07-12 EP disclosed
EP-0860455-A2 Photocrosslinkable polymers Rolic AG (CH) 1998-08-26 EP disclosed
EP-0763552-A2 Curable, photoactive polymeric materials Rolic AG (CH) 1997-03-19 EP disclosed
EP-0572900-A2 Coating and its use in a process for preparing multilayer coatings Herberts Gesellschaft mit beschränkter Haftung (DE) 1993-12-08 EP disclosed
EP-0269288-B1 INTRAOCULAR LENSES KINGSTON TECHNOLOGIES, INC. (US) 1992-02-19 EP disclosed
EP-0269288-A1 Intraocular lenses KINGSTON TECHNOLOGIES, INC. (US) 1988-06-01 EP disclosed
US-4731079-A Intraocular lenses KINGSTON TECHNOLOGIES, INC. (US) 1988-03-15 US disclosed
EP-0181161-A2 Oral hygiene products Stafford-Miller Ltd. (GB) 1986-05-14 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 (2 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-12012382-B2 Polymerizable liquid crystal having a carbazole core FZD7, CCL11, SGK2 CYP2C19 148/4885ALDH1A1 2627/4885LMNA 2536/4885
US-12006463-B2 Polymerizable liquid crystal having a quinoxaline-hydrazone core AQP1, AQP4, HCN1 CYP2C19 1068/4885ALDH1A1 1459/4885LMNA 732/4885

“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.