SCHEMBL9774624

SCHEMBL9774624

Cc1ccccc1C=O.O=C(O)c1cc(-c2ccccc2)ccc1O

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 7/20 0.67
▸ ACMSD Q8TDX5 6/20 0.67
▸ HNF4A P41235 2/20 0.67
▸ DHFR P00374 1/20 0.67
▸ GSTA1 P08263 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ ERN1 O75460 2/20 0.49
▸ LCK P06239 1/20 0.48
▸ LDHA P00338 1/20 0.47
▸ LDHB P07195 1/20 0.47
▸ HAO1 Q9UJM8 1/20 0.47

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
SCHEMBL29759663 0.82 ACMSD (1.00) MCL1ACMSDHNF4ADHFRGSTA1
SCHEMBL23143193 0.82 ACMSD (1.00) MCL1ACMSDHNF4ADHFRGSTA1
SCHEMBL9273036 0.82 ACMSD (1.00) MCL1ACMSDHNF4ADHFRGSTA1
SCHEMBL330602 0.82 ACMSD (1.00) MCL1ACMSDHNF4ADHFRGSTA1
SCHEMBL9652822 0.80 ACMSD (0.96) MCL1ACMSDHNF4ADHFRGSTA1
SCHEMBL9774603 0.77 MCL1 (0.44) MCL1ACMSDHNF4ADHFRALDH1A1
Toluic Acid SCHEMBL6553607 0.77 ALDH1A1 (0.67) DHFRALDH1A1TSHR
SCHEMBL9973581 0.77 ACMSD (0.59) MCL1ACMSDHNF4ADHFRGSTA1
SCHEMBL29374831 0.76 ACMSD (0.88) MCL1ACMSDHNF4ADHFRGSTA1
SCHEMBL18224311 0.76 ACMSD (0.88) MCL1ACMSDHNF4ADHFRGSTA1

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-5034370-A Reaction product of a salicylic acid derivative with formaldehyde and an aromatic compound SUMITOMO DUREZ COMPANY, LTD. (JP) 1991-07-23 — — US disclosed
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