SCHEMBL8875432

SCHEMBL8875432

CCCCCCCCc1ncc(-c2ccc(O)cc2)cn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
RAB9A P51151 3/20 0.57
NPC1 O15118 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
STAT3 P40763 1/20 0.57
ATM Q13315 1/20 0.57
ALDH1A1 P00352 3/20 0.53
PTGS2 P35354 3/20 0.53
ESR1 P03372 2/20 0.53
ADRA2A P08913 2/20 0.53
ADORA3 P0DMS8 2/20 0.53
TACR2 P21452 2/20 0.53
SLC6A2 P23975 2/20 0.53
SLC6A4 P31645 2/20 0.53
SLC6A3 Q01959 2/20 0.53
TP53 P04637 2/20 0.53
CYP3A4 P08684 2/20 0.53
KDM4E B2RXH2 2/20 0.53
HSD17B10 Q99714 2/20 0.53
LMNA P02545 1/20 0.53

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
SCHEMBL10743226 1.00 MAPT (0.57) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10654380 0.86 KMT2A (0.53) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL8552964 0.83 RAB9A (0.49) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL28351808 0.82 PTGS2 (0.48) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL18005443 0.82 PTGS2 (0.48) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL8168071 0.82 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL7872685 0.82 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL9252387 0.81 RAB9A (0.67) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL9347743 0.81 RAB9A (0.67) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL7090931 0.81 RAB9A (0.67) MAPTRAB9ANPC1SMN1; SMN2STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5641428-A SHORT SWITCHING TIMES HOECHST AKTIENGESELLSCHAFT (DE) 1997-06-24 US disclosed
US-5380460-A Ferroelectric liquid crystal compounds containing chiral haloalkoxy tail units and compositions containing them DISPLAYTECH, INC. (US) 1995-01-10 US disclosed
EP-0295370-B1 LIQUID-CRYSTALLINE 5-PHENYL PYRIMIDINE DERIVATIVES WITH AN SC OR SC (ASTERISK) PHASE, AND METHOD FOR PREPARING THEM HOECHST AKTIENGESELLSCHAFT (DE) 1993-08-11 EP disclosed
WO-1993006192-A1 FERROELECTRIC LIQUID CRYSTAL COMPOUNDS CONTAINING CHIRAL HALOALKOXY TAIL UNITS AND COMPOSITIONS CONTAINING THEM DISPLAYTECH, INCORPORATED (US) 1993-04-01 WO disclosed
EP-0288813-B1 USE OF OPTICALLY ACTIVE 1,3-DIOXOLANE-4-CARBOXYLIC-ACID ESTERS AS DOPING AGENTS IN LIQUID CRYSTALS HOECHST AKTIENGESELLSCHAFT (DE) 1990-11-14 EP disclosed
US-4906752-A Liquid-crystal 5-phenylpyrimidine derivatives having sc or sc* phases and a process for preparing them HOECHST AKTIENGESELLSCHAFT (DE) 1990-03-06 US disclosed
EP-0288813-A1 Use of optically active 1,3-dioxolane-4-carboxylic-acid esters as doping agents in liquid crystals HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-02 EP disclosed