SCHEMBL8970762

SCHEMBL8970762

CCCCCCCCSc1ncc(-c2ccc(O)cc2)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MAPT P10636 1/20 0.47
STAT3 P40763 1/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 2/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NR5A1 Q13285 1/20 0.42
PTGES O14684 2/20 0.42
ESR1 P03372 3/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41

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
SCHEMBL9224618 1.00 NPC1 (0.47) NPC1RAB9AMAPTSTAT3ATM
SCHEMBL9507636 1.00 NPC1 (0.47) NPC1RAB9AMAPTSTAT3ATM
SCHEMBL9506149 0.82 ALDH1A1 (0.50) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9507596 0.82 ALDH1A1 (0.50) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9507613 0.82 ALDH1A1 (0.50) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9506292 0.82 ALDH1A1 (0.50) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9506321 0.82 ALDH1A1 (0.50) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9506166 0.82 ALDH1A1 (0.50) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9510040 0.82 ALDH1A1 (0.50) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9506138 0.82 ALDH1A1 (0.50) NPC1RAB9AMAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0376294-B1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI LTD (JP) 1996-03-13 EP disclosed
US-5370821-A Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-06 US disclosed
US-5269965-A Optically active compounds, liquid crystal compositions comprising said compounds and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES (JP) 1993-12-14 US disclosed
EP-0292954-B1 USE OF OPTICALLY ACTIVE OXIRANE-2-CARBOXYLIC ACID ESTERS AS DOPANTS IN LIQUID CRYSTAL MIXTURES CONTAINING THEM AND NEW OPTICALLY ACTIVE OXIRANE-2-CARBOXYLIC ACID ESTERS HOECHST AKTIENGESELLSCHAFT (DE) 1993-05-05 EP disclosed
EP-0538292-A1 METHOD OF SEPARATING 2-ALKYLTHIO-5-PHENYLPYRIMIDINES FROM REACTION MIXTURES BY EXTRACTION HOECHST AKTIENGESELLSCHAFT (DE) 1993-04-28 EP disclosed
WO-1992000969-A1 METHOD OF SEPARATING 2-ALKYLTHIO-5-PHENYLPYRIMIDINES FROM REACTION MIXTURES BY EXTRACTION HOECHST AKTIENGESELLSCHAFT (DE) 1992-01-23 WO disclosed
US-4988459-A Electrooptic switches or display HOECHST AKTIENGESELLSCHAFT (DE) 1991-01-29 US disclosed
EP-0376294-A1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI, LTD. (JP) 1990-07-04 EP disclosed
EP-0334925-A1 FERROELECTRIC LIQUID CRYSTALLINE PHASES MERCK PATENT GmbH (DE) 1989-10-04 EP disclosed
WO-1989003416-A1 FERROELECTRIC LIQUID CRYSTALLINE PHASES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-04-20 WO disclosed
EP-0292954-A2 Use of optically active oxirane-2-carboxylic acid esters as dopants in liquid crystal mixtures containing them and new optically active oxirane-2-carboxylic acid esters HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-30 EP disclosed