SCHEMBL11422940

SCHEMBL11422940

COC(=O)c1ccc(/C=N/c2ccc(Cl)cc2C)c(C(=O)OC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ KMT2A Q03164 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.39
▸ MAPT P10636 5/20 0.39
▸ ATM Q13315 3/20 0.39
▸ GLA P06280 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CA1 P00915 1/20 0.38

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
SCHEMBL11422945 1.00 ALDH1A1 (0.41) ALDH1A1HPGDHSD17B10TSHRKDM4E
SCHEMBL11428163 0.91 KDM4E (0.45) ALDH1A1HPGDHSD17B10KDM4EABL1
SCHEMBL11428164 0.91 KDM4E (0.45) ALDH1A1HPGDHSD17B10KDM4EABL1
SCHEMBL11408874 0.84 MEN1 (0.45) ALDH1A1HPGDHSD17B10TSHRKDM4E
SCHEMBL11408875 0.84 MEN1 (0.45) ALDH1A1HPGDHSD17B10TSHRKDM4E
SCHEMBL11408879 0.80 CA1 (0.46) ALDH1A1HPGDHSD17B10KDM4EABL1
SCHEMBL11423214 0.80 CA1 (0.46) ALDH1A1HPGDHSD17B10KDM4EABL1
SCHEMBL11418993 0.79 ALDH1A1 (0.49) ALDH1A1HPGDHSD17B10TSHRKDM4E
SCHEMBL11418991 0.79 ALDH1A1 (0.49) ALDH1A1HPGDHSD17B10TSHRKDM4E
SCHEMBL11431151 0.75 MEN1 (0.46) ALDH1A1HPGDHSD17B10TSHRKDM4E

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-4200648-A INFLAMMATION BY ADMINISTERING A BENZYLIDENEANILINE DERIVATIVE WILLIAM H. RORER, INC. (US) 1980-04-29 — — US disclosed
US-4198349-A ANTIINFLAMMATORY, TOPICAL WILLIAM H. RORER, INC. (US) 1980-04-15 — — US disclosed
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