SCHEMBL11104544

SCHEMBL11104544

CCc1ccc(Cc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.87
▸ SRD5A2 P31213 3/20 0.63
▸ RXRA P19793 3/20 0.62
▸ RXRB P28702 3/20 0.62
▸ PLK1 P53350 1/20 0.59
▸ KMT2A Q03164 2/20 0.56
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ LMNA P02545 1/20 0.53
▸ BCL2 P10415 1/20 0.53
▸ TSHR P16473 2/20 0.52
▸ TP53 P04637 1/20 0.52
▸ RARB P10826 2/20 0.52
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ CA14 Q9ULX7 1/20 0.51
▸ RXRG P48443 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
SCHEMBL1330795 0.93 ALDH1A1 (1.00) ALDH1A1SRD5A2RXRARXRBPLK1
SCHEMBL19901 0.93 ALDH1A1 (1.00) ALDH1A1SRD5A2RXRARXRBPLK1
SCHEMBL1330335 0.93 ALDH1A1 (1.00) ALDH1A1SRD5A2RXRARXRBPLK1
Dimethylamine SCHEMBL7283965 0.91 ALDH1A1 (0.87) ALDH1A1SRD5A2RXRARXRBPLK1
SCHEMBL6911296 0.91 ALDH1A1 (0.95) ALDH1A1SRD5A2RXRARXRBPLK1
SCHEMBL6907764 0.91 ALDH1A1 (0.95) ALDH1A1SRD5A2RXRARXRBPLK1
SCHEMBL6915465 0.91 ALDH1A1 (0.95) ALDH1A1SRD5A2RXRARXRBPLK1
SCHEMBL6909432 0.91 ALDH1A1 (0.95) ALDH1A1SRD5A2RXRARXRBPLK1
Ammonia Solution, Strong SCHEMBL22042012 0.91 ALDH1A1 (0.95) ALDH1A1SRD5A2RXRARXRBPLK1
SCHEMBL10547845 0.91 ALDH1A1 (0.95) ALDH1A1SRD5A2RXRARXRBPLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4430326-A Method of diminishing glucose levels resulting from endogenous glucagon UNIVERSITY PATENTS, INC. (US) 1984-02-07 — — US disclosed
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