SCHEMBL11477348

SCHEMBL11477348

CCCCCCCCCCC(C)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.49
▸ TSHR P16473 2/20 0.49
▸ RARB P10826 8/20 0.48
▸ PLA2G4B P0C869 5/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ RARA P10276 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ MTOR P42345 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ MLYCD O95822 1/20 0.47
▸ HSP90AA1 P07900 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL9063291 1.00 TP53 (0.49) TP53TSHRRARBPLA2G4BALDH1A1
SCHEMBL11558611 1.00 TP53 (0.49) TP53TSHRRARBPLA2G4BALDH1A1
SCHEMBL8650224 0.98 MLYCD (0.48) TP53TSHRRARBPLA2G4BALDH1A1
SCHEMBL31572052 0.87 ALDH1A1 (0.52) TP53TSHRALDH1A1MAPTKMT2A
SCHEMBL11562403 0.86 MLYCD (0.43) TP53TSHRALDH1A1MAPTMLYCD
SCHEMBL11559974 0.85 NPC1 (0.51) ALDH1A1MEN1MAPTKMT2AMLYCD
Hydrochloric Acid SCHEMBL11559328 0.85 MLYCD (0.45) TP53TSHRALDH1A1MEN1KMT2A
SCHEMBL1417508 0.85 ALDH1A1 (0.56) TP53TSHRALDH1A1MEN1MAPT
SCHEMBL11513573 0.85 ALDH1A1 (0.56) TP53TSHRALDH1A1MEN1MAPT
SCHEMBL11520102 0.85 ALDH1A1 (0.56) TP53TSHRALDH1A1MEN1MAPT

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-4198522-A HYPOLIPIDEMIC ACND ANTI-ATHEROSCLEROTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1980-04-15 — — US disclosed
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