SCHEMBL2921040

SCHEMBL2921040

CCOC(=O)n1nc(NC(=O)c2ccc(N3CCN(C4CC4)CC3)cc2)c2c1CNC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 3/20 0.37
ALOX15 P16050 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALDH1A1 P00352 1/20 0.37
AURKA O14965 4/20 0.37
FLT3 P36888 2/20 0.36
KDR P35968 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
GAA P10253 2/20 0.36
ALOX12 P18054 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
LIMK1 P53667 1/20 0.35
LIMK2 P53671 1/20 0.35
AURKB Q96GD4 1/20 0.35

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
Hydrochloric Acid SCHEMBL3899899 0.99 FGFR1 (0.40) FGFR1KMT2AMEN1MAPTALOX15
SCHEMBL2928661 0.89 KMT2A (0.38) KMT2AMEN1MAPTALOX15HSD17B10
SCHEMBL5449603 0.89 MEN1 (0.49) KMT2AMEN1MAPTALOX15HSD17B10
Hydrochloric Acid SCHEMBL5894517 0.89 KMT2A (0.38) KMT2AMEN1MAPTALOX15HSD17B10
Hydrochloric Acid SCHEMBL2927668 0.88 MEN1 (0.48) KMT2AMEN1MAPTALOX15HSD17B10
SCHEMBL6503870 0.88 FGFR1 (0.45) FGFR1KMT2AMEN1AURKAFLT3
SCHEMBL2922698 0.88 KMT2A (0.47) FGFR1KMT2AMEN1MAPTALOX15
Hydrochloric Acid SCHEMBL2927706 0.88 FGFR1 (0.44) FGFR1KMT2AMEN1AURKAFLT3
SCHEMBL3903873 0.87 FGFR1 (0.42) FGFR1KMT2AMEN1MAPTALOX15
Hydrochloric Acid SCHEMBL2929385 0.86 KMT2A (0.38) FGFR1KMT2AMEN1MAPTALOX15

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
EP-2231643-A1 AMIDOMETHYL-SUBSTITUTED OXINDOLE DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF VASOPRESSIN-DEPENDENT ILLNESSES Abbott GmbH & Co. KG (DE) 2010-09-29 EP disclosed
EP-1644376-B1 PYRROLO 3,4-c PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2010-09-08 EP disclosed
WO-2009071687-A1 AMIDOMETHYL-SUBSTITUTED OXINDOLE DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF VASOPRESSIN-DEPENDENT ILLNESSES ABBOTT GMBH & CO. KG (DE) 2009-06-11 WO disclosed