SCHEMBL11380402

SCHEMBL11380402

CC(O)(c1ccc(Cl)cc1)c1cc(Cl)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.61
▸ KMT2A Q03164 4/20 0.61
▸ CNR2 P34972 1/20 0.43
▸ HSD17B10 Q99714 6/20 0.42
▸ TSHR P16473 3/20 0.42
▸ MAPK1 P28482 3/20 0.41
▸ HIF1A Q16665 3/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ HTT P42858 4/20 0.40
▸ LMNA P02545 3/20 0.40
▸ KCNH2 Q12809 2/20 0.40
▸ HSD17B2 P37059 1/20 0.40
▸ HSP90AA1 P07900 3/20 0.40
▸ HSP90AB1 P08238 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ALOX15 P16050 5/20 0.39
▸ ALDH1A1 P00352 5/20 0.39
▸ HPGD P15428 4/20 0.39
▸ ALOX12 P18054 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39

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
SCHEMBL11370625 0.89 HSP90AA1 (0.50) MEN1KMT2ACNR2HSD17B10TSHR
SCHEMBL11366071 0.84 P2RX1 (0.42) MEN1KMT2ACNR2HSD17B10TSHR
SCHEMBL818330 0.80 HSD17B10 (0.48) MEN1KMT2AHSD17B10TSHRMAPK1
SCHEMBL11370942 0.79 P2RX1 (0.47) MEN1KMT2ACNR2SMN1; SMN2HTT
SCHEMBL11317922 0.78 HSD17B10 (0.50) MEN1KMT2AHSD17B10TSHRMAPK1
SCHEMBL768507 0.78 ALDH1A1 (0.61) MEN1KMT2AHSD17B10TSHRMAPK1
SCHEMBL26402 0.77 MEN1 (1.00) MEN1KMT2ATSHRMAPK1HIF1A
SCHEMBL11362042 0.77 ESRRA (0.45) MEN1KMT2ACNR2TSHRSMN1; SMN2
SCHEMBL11379540 0.76 MEN1 (0.48) MEN1KMT2ACNR2HSD17B10TSHR
SCHEMBL11377663 0.76 CNR1 (0.42) MEN1KMT2ACNR2HSD17B10TSHR

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-4294845-A ANTILIPEMIC AGENTS ROUSSEL UCLAF, A CORP. OF FRANCE (FR) 1981-10-13 — — US disclosed
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