SCHEMBL8668000

SCHEMBL8668000

CCCCc1c2c(cc(NC(=O)c3ccccc3)c1N1CCCC1)-c1ccccc1C2C(=O)NCC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ POLB P06746 2/20 0.36
▸ BCHE P06276 2/20 0.36
▸ SSTR2 P30874 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ CNR2 P34972 1/20 0.34
▸ BRPF1 P55201 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ DRD4 P21917 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ ACKR3 P25106 1/20 0.34
▸ MAPK14 Q16539 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33

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
SCHEMBL8667926 0.89 MEN1 (0.37) KMT2AMEN1POLBTP53GAA
Hydrochloric Acid SCHEMBL8663917 0.88 MEN1 (0.36) KMT2AMEN1POLBTP53GAA
SCHEMBL8501146 0.88 POLB (0.35) KMT2AMEN1POLBDRD2DRD4
SCHEMBL8662751 0.87 KMT2A (0.35) KMT2AMEN1POLBBCHESSTR2
SCHEMBL8504394 0.87 MEN1 (0.37) KMT2AMEN1POLBTP53GAA
SCHEMBL8503676 0.87 POLB (0.35) POLBALDH1A1DRD2DRD4DRD3
SCHEMBL8523535 0.85 KMT2A (0.40) KMT2AMEN1POLBALDH1A1BRPF1
SCHEMBL8667146 0.81 RXFP1 (0.34) KMT2AMEN1GAA
SCHEMBL8593680 0.81 POLB (0.42) KMT2APOLBALDH1A1DRD2DRD4
SCHEMBL8500999 0.80 CTSL (0.37) POLBALDH1A1DRD2DRD4DRD3

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-5827875-A PYRROLIDINE DERIVATIVES; ANTIATHEROSCLEROSIS AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-10-27 — — US claimed
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