SCHEMBL16378797

SCHEMBL16378797

CCC(CC)c1ccc2c(-c3ccccc3C(=O)O)c3ccc(=[N+](CC)CC)cc-3oc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 4/20 0.44
▸ USP2 O75604 5/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ BLM P54132 3/20 0.44
▸ POLB P06746 3/20 0.44
▸ PPARG P37231 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ NCOR2 Q9Y618 1/20 0.44
▸ FTO Q9C0B1 2/20 0.42
▸ TGM2 P21980 1/20 0.41
▸ ABCB1 P08183 1/20 0.40
▸ ATM Q13315 2/20 0.39
▸ CFTR P13569 1/20 0.39
▸ PAX8 Q06710 1/20 0.39
▸ GOPC Q9HD26 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ THRB P10828 2/20 0.38
▸ RECQL P46063 2/20 0.38
▸ TDP1 Q9NUW8 2/20 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
SCHEMBL19494774 0.86 USP2 (0.53) FPR2USP2MEN1KMT2ABLM
SCHEMBL12763951 0.86 POLB (0.50) FPR2USP2MEN1KMT2ABLM
SCHEMBL17109310 0.85 ABCB1 (0.44) FPR2USP2MEN1KMT2ABLM
SCHEMBL19085489 0.85 FPR2 (0.45) FPR2USP2MEN1KMT2ABLM
SCHEMBL19494880 0.84 ABCB1 (0.45) FPR2USP2MEN1KMT2ABLM
SCHEMBL19495008 0.83 ABCB1 (0.42) FPR2USP2MEN1KMT2ABLM
SCHEMBL3903552 0.83 MEN1 (0.61) FPR2USP2MEN1KMT2ABLM
SCHEMBL29593395 0.83 MEN1 (0.61) FPR2USP2MEN1KMT2ABLM
SCHEMBL23134951 0.82 USP2 (0.42) FPR2USP2MEN1KMT2ABLM
Hydrochloric Acid SCHEMBL18617 0.82 MEN1 (0.60) FPR2USP2MEN1KMT2ABLM

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-8932370-B2 Coloring agents and methods of use thereof LIVING PROOF, INC. (US) 2015-01-13 — — US disclosed
US-8932370-B2 Coloring agents and methods of use thereof LIVING PROOF, INC. (US) 2015-01-13 — — US disclosed
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