SCHEMBL6683977

SCHEMBL6683977

O=C1Nc2ccc(Cl)cc2/C1=C/Nc1ccc2[nH]ccc2c1.O=C1Nc2ccc(Cl)cc2/C1=C\Nc1ccc(CO)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.45
TDO2 P48775 2/20 0.45
TGM2 P21980 2/20 0.44
PDGFRB P09619 1/20 0.42
LRRK2 Q5S007 7/20 0.41
PSEN1 P49768 4/20 0.40
PSEN2 P49810 4/20 0.40
APH1B Q8WW43 4/20 0.40
NCSTN Q92542 4/20 0.40
APH1A Q96BI3 4/20 0.40
PSENEN Q9NZ42 4/20 0.40
NTRK1 P04629 1/20 0.40
MAOB P27338 1/20 0.39
CDYL2 Q8N8U2 1/20 0.39
CDYL Q9Y232 1/20 0.39
CDY1; CDY1B Q9Y6F8 1/20 0.39
NHERF1 O14745 1/20 0.38
PYGL P06737 1/20 0.38
F7 P08709 1/20 0.38
LTA4H P09960 1/20 0.38

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
SCHEMBL6683982 1.00 IDO1 (0.45) IDO1TDO2TGM2PDGFRBLRRK2
SCHEMBL4993255 0.91 PDGFRB (0.49) IDO1TDO2TGM2PDGFRBLRRK2
SCHEMBL4993258 0.91 PDGFRB (0.49) IDO1TDO2TGM2PDGFRBLRRK2
SCHEMBL5011975 0.88 IDO1 (0.56) IDO1TDO2TGM2PDGFRBLRRK2
SCHEMBL5011977 0.88 IDO1 (0.56) IDO1TDO2TGM2PDGFRBLRRK2
SCHEMBL4994415 0.79 CDK2 (0.47) NTRK1AHR
SCHEMBL4994417 0.79 CDK2 (0.47) NTRK1AHR
SCHEMBL4988836 0.78 MAPT (0.45) IDO1TGM2PDGFRBLRRK2NTRK1
SCHEMBL4988837 0.78 MAPT (0.45) IDO1TGM2PDGFRBLRRK2NTRK1
SCHEMBL4987869 0.77 IDO1 (0.56) IDO1TDO2TGM2PDGFRBLRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1430048-A1 3-(ARYLAMINO)METHYLENE-1, 3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS Allergan, Inc. (US) 2004-06-23 EP disclosed
WO-2003027102-A1 3-(ARYLAMINO)METHYLENE-1, 3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS ALLERGAN, INC. (US) 2003-04-03 WO disclosed