SCHEMBL6880694

SCHEMBL6880694

CCN1C(=O)C(=CNc2ccc(-n3[nH]c(=O)cc3C)cc2)c2cccnc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.34
APP P05067 4/20 0.34
SNCA P37840 4/20 0.34
GAA P10253 1/20 0.32
HKDC1 Q2TB90 1/20 0.32
METAP2 P50579 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MCL1 Q07820 1/20 0.32
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
CYP1A2 P05177 1/20 0.31
HPGD P15428 1/20 0.31
S1PR4 O95977 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CYP3A4 P08684 1/20 0.30
CHEK1 O14757 1/20 0.30
AURKA O14965 1/20 0.30
DAPK3 O43293 1/20 0.30
JAK2 O60674 1/20 0.30
PRKD3 O94806 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
SCHEMBL5873791 0.79 MAPT (0.40) MAPTAPPSNCAGAAALDH1A1
SCHEMBL5873788 0.79 MAPT (0.40) MAPTAPPSNCAGAAALDH1A1
SCHEMBL7661382 0.76 TRPV1 (0.44) MAPTALDH1A1MCL1CYP2C9CYP2C19
SCHEMBL5873955 0.75 KMT2A (0.39) MAPTGAAALDH1A1CYP2C9CYP2C19
SCHEMBL6872495 0.75 KMT2A (0.39) MAPTGAAALDH1A1CYP2C9CYP2C19
SCHEMBL7704854 0.72 CCNT1 (0.40) MAPTAPPSNCAALDH1A1CDK9
SCHEMBL5430107 0.71 CYP1A2 (0.33) MAPTCYP2C9CYP2C19CYP1A2HPGD
SCHEMBL5430111 0.71 CYP1A2 (0.33) MAPTCYP2C9CYP2C19CYP1A2HPGD
SCHEMBL6880716 0.70 NTRK1 (0.39) MAPTAPPALDH1A1NTRK1FLT3
SCHEMBL6880710 0.70 NTRK1 (0.39) MAPTAPPALDH1A1NTRK1FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6818632-B2 3-(anilinomethylene)oxindoles SMITHKLINE BEECHAM CORPORATION 2004-11-16 US disclosed
EP-1165514-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2002-01-02 EP disclosed
WO-2000056710-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-09-28 WO disclosed