SCHEMBL8617142

SCHEMBL8617142

Cc1ccc(C[CH]COc2ccc(Cl)c3[nH]cc(Cl)c23)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
ALOX12 P18054 1/20 0.30
MAPK1 P28482 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8489503 0.90 CDC7 (0.30)
SCHEMBL8492022 0.87 LTA4H (0.34)
SCHEMBL7473564 0.76 KMT2A (0.39) KMT2A
SCHEMBL8617146 0.72 PPARG (0.34)
SCHEMBL7207522 0.69 MEN1 (0.31) MEN1USP2ALDH1A1POLBMAPT
SCHEMBL8620184 0.66 NQO2 (0.35) ALDH1A1MAPTL3MBTL1
SCHEMBL7482639 0.63 KMT2A (0.42) MEN1ALDH1A1MAPK1CYP2C19KMT2A
SCHEMBL7207966 0.62 KMT2A (0.51) POLBKMT2A
SCHEMBL9064997 0.61 IDO1 (0.50) ALDH1A1POLBMAPT
SCHEMBL8489926 0.60 PPARA (0.34)

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-5817690-A ANTIDOPAMINE AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1998-10-06 US disclosed