SCHEMBL27846546

SCHEMBL27846546

Oc1cnc(-c2ccccc2Cl)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.47
▸ ALOX5AP P20292 1/20 0.43
▸ FEN1 P39748 1/20 0.43
▸ ABL1 P00519 1/20 0.40
▸ PRKDC P78527 1/20 0.40
▸ ATR Q13535 1/20 0.40
▸ OXTR P30559 1/20 0.40
▸ AVPR1A P37288 1/20 0.40
▸ USP7 Q93009 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ HSP90AB1 P08238 1/20 0.40
▸ HPGD P15428 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39

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
SCHEMBL11679050 0.80 IDO1 (0.50) IDO1ALOX5APFEN1ABL1PRKDC
SCHEMBL2030727 0.77 FEN1 (0.66) IDO1ALOX5APFEN1HSP90AA1HSP90AB1
SCHEMBL5934219 0.75 ALPL (0.49) IDO1ABL1PRKDCATRHPGD
SCHEMBL15060604 0.73 CYP1A2 (0.45) IDO1ALOX5APFEN1ABL1OXTR
SCHEMBL20068878 0.72 USP7 (0.53) IDO1ALOX5APFEN1ABL1USP7
SCHEMBL8136723 0.71 HSD17B1 (0.52) IDO1SMN1; SMN2MEN1KMT2ANPC1
SCHEMBL10900657 0.71 IDO1 (0.48) IDO1ALOX5APFEN1PRKDCATR
SCHEMBL3948877 0.71 IDO1 (0.48) IDO1ALOX5APFEN1HPGDSMN1; SMN2
SCHEMBL18856143 0.69 PABPC1 (0.37) ALOX5APFEN1ATRHSP90AA1HSP90AB1
SCHEMBL13017168 0.69 CYP1A2 (0.42) IDO1ALOX5APFEN1OXTRAVPR1A

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
CN-102209710-A Pyrrolidines PFIZER LTD 2011-10-05 — — CN disclosed
Send feedback