SCHEMBL7872685

SCHEMBL7872685

CCCCCCc1ccc(-c2ccc(O)cc2)cn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
RAB9A P51151 3/20 0.56
NPC1 O15118 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
STAT3 P40763 1/20 0.56
ATM Q13315 1/20 0.56
ESR1 P03372 2/20 0.51
ADRA2A P08913 2/20 0.51
ADORA3 P0DMS8 2/20 0.51
TACR2 P21452 2/20 0.51
SLC6A2 P23975 2/20 0.51
SLC6A4 P31645 2/20 0.51
SLC6A3 Q01959 2/20 0.51
TP53 P04637 2/20 0.51
CYP3A4 P08684 2/20 0.51
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
HSD17B10 Q99714 2/20 0.51
LMNA P02545 1/20 0.51
SHBG P04278 1/20 0.51

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
SCHEMBL8168071 1.00 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL19309207 0.86 PTGS2 (0.53) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10462220 0.85 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10462486 0.85 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10462015 0.85 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10461203 0.85 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10461041 0.85 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10460929 0.85 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10462330 0.85 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2STAT3
SCHEMBL10462501 0.85 MAPT (0.56) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618914-B1 OXIRANYL METHYL ETHERS EXHIBITING CHIRALITY, AND THEIR USE AS DOPANTS IN LIQUID-CRYSTAL MIXTURES AVENTIS RES & TECH GMBH & CO (DE) 2001-10-17 EP disclosed
US-5707545-A OPTICAL APPARATUS FOR ELCTRONICS HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-13 US disclosed
EP-0618914-A1 OXIRANYL METHYL ETHERS EXHIBITING CHIRALITY, AND THEIR USE AS DOPANTS IN LIQUID-CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-12 EP disclosed
WO-1993013093-A1 OXIRANYL METHYL ETHERS EXHIBITING CHIRALITY, AND THEIR USE AS DOPANTS IN LIQUID-CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-08 WO disclosed