SCHEMBL11568432

SCHEMBL11568432

CCCCCc1ccc(-c2ccc(CCCCC)c(-c3ccccc3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.52
RARB P10826 10/20 0.49
RARA P10276 2/20 0.48
RARG P13631 1/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
MTOR P42345 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GPR3 P46089 1/20 0.44
TLR8 Q9NR97 1/20 0.44
PSMB5 P28074 1/20 0.44

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
SCHEMBL21693629 0.89 PSMB5 (0.54) HSD11B1RARBMAPTGPR3TLR8
SCHEMBL11323213 0.89 PSMB5 (0.42) HSD11B1RARBRARARARGTLR8
SCHEMBL1203500 0.83 HSD11B1 (0.69) HSD11B1RARBRARAMEN1ALDH1A1
SCHEMBL25867877 0.82 LIPG (0.47) HSD11B1RARBRARAMEN1ALDH1A1
SCHEMBL9016235 0.82 GPR3 (0.50) RARBRARAMEN1ALDH1A1MAPT
SCHEMBL5595171 0.82 SMN1; SMN2 (0.40) RARBRARARARGMEN1ALDH1A1
SCHEMBL8657644 0.82 PPARA (0.52) HSD11B1TLR8
SCHEMBL29939361 0.82 HSD11B1 (0.63) HSD11B1RARBRARAMEN1ALDH1A1
SCHEMBL5599589 0.82 HSD11B1 (0.67) HSD11B1RARBRARARARGMEN1
SCHEMBL9158137 0.82 HSD11B1 (0.67) HSD11B1RARBRARARARGMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4147728-A Disubstituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1979-04-03 US disclosed
US-4064176-A Di-substituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1977-12-20 US disclosed
US-4045414-A New di-substituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1977-08-30 US disclosed