SCHEMBL8658267

SCHEMBL8658267

NC(=O)N1C(=O)C(C(=O)c2cccs2)c2ncc(C(F)(F)F)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.39
MAPT P10636 4/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 4/20 0.36
PKM P14618 1/20 0.36
P2RX4 Q99571 1/20 0.35
ALDH1A1 P00352 4/20 0.35
GAA P10253 2/20 0.35
ABL1 P00519 2/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CNR2 P34972 2/20 0.34
RAB9A P51151 1/20 0.34
CNR1 P21554 1/20 0.34
SRPK1 Q96SB4 1/20 0.34
TRPA1 O75762 2/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL8654893 0.86 ALDH1A1 (0.35) KDM4EMAPTPOLBNPSR1ALDH1A1
SCHEMBL8653981 0.84 MEN1 (0.35) MAPTPOLBALDH1A1GAAABL1
SCHEMBL27358632 0.78 KDM4E (0.34) KDM4EMAPTPOLBNPSR1ALDH1A1
SCHEMBL8654892 0.76 KMT2A (0.35) KDM4EMAPTPOLBALDH1A1GAA
SCHEMBL9753843 0.74 RAB9A (0.38) KDM4EMAPTPOLBNPSR1ALDH1A1
SCHEMBL8657517 0.74 HSD17B10 (0.35) KDM4EMAPTPOLBNPSR1ALDH1A1
SCHEMBL8654402 0.74 TDP1 (0.38) MAPTPOLBALDH1A1GAACYP2C9
SCHEMBL8597852 0.73 GAA (0.36) KDM4EMAPTPOLBALDH1A1GAA
SCHEMBL8657711 0.72 ALDH1A1 (0.36) KDM4EPOLBNPSR1ALDH1A1GAA
SCHEMBL8653577 0.72 ALDH1A1 (0.36) KDM4EPOLBNPSR1ALDH1A1GAA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991009598-A1 AZAOXINDOLE DERIVATIVES PFIZER INC. (US) 1991-07-11 WO claimed
US-5811432-A Azaoxindole derivatives PFIZER INC (US) 1998-09-22 US disclosed
CN-1031053-C Azaoxindole derivatives PFIZER (US) 1996-02-21 CN disclosed
CN-1053065-A AZAOXINDOLE DERIVATIVES PFIZER (US) 1991-07-17 CN disclosed
WO-1991009598-A1 AZAOXINDOLE DERIVATIVES PFIZER INC. (US) 1991-07-11 WO disclosed
EP-0436333-A2 Azaoxindole derivatives PFIZER INC. (US) 1991-07-10 EP disclosed