SCHEMBL9226643

SCHEMBL9226643

CCCCCCCCc1ccc(-c2ccc(O)nc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
NPC1 O15118 1/20 0.56
STAT3 P40763 1/20 0.56
ATM Q13315 1/20 0.56
ALDH1A1 P00352 3/20 0.56
HSD17B10 Q99714 3/20 0.56
ESR1 P03372 2/20 0.56
ADRA2A P08913 2/20 0.56
ADORA3 P0DMS8 2/20 0.56
TACR2 P21452 2/20 0.56
SLC6A2 P23975 2/20 0.56
SLC6A4 P31645 2/20 0.56
SLC6A3 Q01959 2/20 0.56
KDM4E B2RXH2 2/20 0.56
LMNA P02545 1/20 0.56
SHBG P04278 1/20 0.56
TP53 P04637 1/20 0.56
CYP3A4 P08684 1/20 0.56

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
SCHEMBL8650839 1.00 MAPT (0.56) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL20016772 0.86 MAPT (0.62) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL14028263 0.83 MAPT (0.55) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL10462220 0.82 MAPT (0.56) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL8080332 0.82 RAB9A (0.70) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL10460929 0.82 MAPT (0.56) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL10461041 0.82 MAPT (0.56) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL7650005 0.82 RAB9A (0.70) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL10462015 0.82 MAPT (0.56) MAPTRAB9ASMN1; SMN2NPC1STAT3
SCHEMBL10462330 0.82 MAPT (0.56) MAPTRAB9ASMN1; SMN2NPC1STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5380460-A Ferroelectric liquid crystal compounds containing chiral haloalkoxy tail units and compositions containing them DISPLAYTECH, INC. (US) 1995-01-10 US 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