SCHEMBL18760308

SCHEMBL18760308

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ POLB P06746 1/20 0.54
▸ PPARG P37231 1/20 0.54
▸ BLM P54132 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.54
▸ NCOR2 Q9Y618 1/20 0.54
▸ FPR2 P25090 4/20 0.54
▸ TGM2 P21980 1/20 0.53
▸ TLR7 Q9NYK1 1/20 0.47
▸ CHRM1 P11229 1/20 0.46
▸ AVPR2 P30518 4/20 0.45
▸ P2RY6 Q15077 1/20 0.43
▸ NPY4R P50391 2/20 0.41
▸ ABCB1 P08183 1/20 0.41
▸ CFTR P13569 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ GOPC Q9HD26 1/20 0.40

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
SCHEMBL18760518 0.92 FPR2 (0.56) USP2MEN1POLBPPARGBLM
SCHEMBL14300324 0.90 MEN1 (0.54) USP2MEN1POLBPPARGBLM
SCHEMBL13033321 0.89 MEN1 (0.56) USP2MEN1POLBPPARGBLM
SCHEMBL9007850 0.88 USP2 (0.59) USP2MEN1POLBPPARGBLM
SCHEMBL12118351 0.88 MEN1 (0.59) USP2MEN1POLBPPARGBLM
SCHEMBL17348121 0.88 TGM2 (0.55) USP2MEN1POLBPPARGBLM
SCHEMBL10000831 0.88 P2RY6 (0.56) USP2MEN1POLBPPARGBLM
Hydrochloric Acid SCHEMBL21112986 0.87 P2RY6 (0.56) USP2MEN1POLBPPARGBLM
SCHEMBL12173012 0.87 TGM2 (0.54) USP2MEN1POLBPPARGBLM
SCHEMBL17662505 0.86 TGM2 (0.53) USP2MEN1POLBPPARGBLM

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
WO-2017064657-A1 FLUORESCENT ANTICANCER PLATINUM DRUGS INVICTUS ONCOLOGY PVT. LTD. (IN) 2017-04-20 — — WO disclosed
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