SCHEMBL9284657

SCHEMBL9284657

C=CCOc1ccc(-c2ncc(OCC=C)cn2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPK1 P28482 1/20 0.48
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
NPC1 O15118 7/20 0.44
RAB9A P51151 6/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
HSD17B10 Q99714 1/20 0.44
CHRNB2 P17787 3/20 0.41
CHRNB4 P30926 3/20 0.41
CHRNA3 P32297 3/20 0.41
CHRNA4 P43681 3/20 0.41
POLB P06746 2/20 0.40
USP2 O75604 1/20 0.40
CACNA1B Q00975 1/20 0.40

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
SCHEMBL9337494 0.88 MAPT (0.44) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL8943288 0.88 NPC1 (0.52) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL10451577 0.87 ALDH1A1 (0.39) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL6025125 0.86 ALDH1A1 (0.43) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL9879580 0.84 FFAR1 (0.48) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL9284642 0.84 NPC1 (0.61) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL9615316 0.84 NPC1 (0.61) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL9429911 0.82 ALDH1A1 (0.44) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL472165 0.82 CA12 (0.57) MAPTALDH1A1KDM4EMAPK1CA12
SCHEMBL9065504 0.82 CA12 (0.57) MAPTALDH1A1KDM4EMAPK1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0464058-B1 FERROELECTRIC LIQUID CRYSTAL MIXTURES HOECHST AG (DE) 1995-06-14 EP disclosed
EP-0464072-B1 LIQUID CRYSTAL MIXTURES, IN PARTICULAR FERROELECTRIC LIQUID CRYSTAL MIXTURES HOECHST AG (DE) 1994-06-15 EP disclosed
EP-0307880-B1 Ferroelectric liquid-crystal mixtures HOECHST AG (DE) 1994-01-12 EP disclosed
EP-0477901-A2 Cyclohexylphenylpyrimidines, process for their preparation und their use in liquid crystal compositions HOECHST AKTIENGESELLSCHAFT (DE) 1992-04-01 EP disclosed
EP-0464058-A1 FERROELECTRIC LIQUID CRYSTAL MIXTURES. HOECHST AG (DE) 1992-01-08 EP disclosed
EP-0464072-A1 LIQUID CRYSTAL MIXTURES, IN PARTICULAR FERROELECTRIC LIQUID CRYSTAL MIXTURES. HOECHST AG (DE) 1992-01-08 EP disclosed
EP-0412409-A2 Liquid crystal mixtures, especially ferroelectric liquid crystal mixtures and their use in electrooptic devices HOECHST AKTIENGESELLSCHAFT (DE) 1991-02-13 EP disclosed
WO-1990011335-A1 FERROELECTRIC LIQUID CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1990-10-04 WO disclosed
WO-1990011336-A1 LIQUID CRYSTAL MIXTURES, IN PARTICULAR FERROELECTRIC LIQUID CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1990-10-04 WO disclosed
EP-0307880-A2 Ferroelectric liquid-crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1989-03-22 EP disclosed