SCHEMBL9360595

SCHEMBL9360595

CCOC(=O)c1ccc(C=CC=C(C#N)C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.49
▸ MCL1 Q07820 2/20 0.47
▸ ALDH1A1 P00352 5/20 0.44
▸ LMNA P02545 4/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ PPARG P37231 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ ESR1 P03372 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ ESR2 Q92731 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAOA P21397 1/20 0.43
▸ HTT P42858 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL9360589 1.00 MAPT (0.49) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9360797 0.95 APP (0.48) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9360803 0.95 APP (0.48) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9364802 0.90 LMNA (0.48) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9364799 0.90 LMNA (0.48) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9360522 0.88 LMNA (0.49) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9360513 0.88 LMNA (0.49) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9364863 0.85 APP (0.46) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9364856 0.85 APP (0.46) MAPTMCL1ALDH1A1LMNAKDM4E
SCHEMBL9362053 0.85 MCL1 (0.50) MAPTMCL1ALDH1A1LMNAKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0335641-B1 Organic nonlinear optical substance TEIJIN LTD (JP) 1994-01-05 — — EP disclosed
US-5196147-A Optical crystals TEIJIN LIMITED (JP) 1993-03-23 — — US disclosed
EP-0335641-A2 Organic nonlinear optical substance TEIJIN LIMITED (JP) 1989-10-04 — — EP disclosed
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