SCHEMBL3157679

SCHEMBL3157679

CCC(C=C1C(=O)Nc2cc(C(N)=O)ccc21)OC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 2/20 0.42
PIM1 P11309 2/20 0.41
TGM2 P21980 2/20 0.40
PDGFRB P09619 1/20 0.37
FGFR1 P11362 1/20 0.37
KDR P35968 1/20 0.37
HSP90AA1 P07900 2/20 0.37
MAPK1 P28482 1/20 0.36
CHEK1 O14757 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
PDGFRA P16234 1/20 0.36
TLK2 Q86UE8 1/20 0.36
CDK1 P06493 1/20 0.35
CCNB1 P14635 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
SCHEMBL3156405 0.85 PDPK1 (0.44) PDPK1PIM1TGM2PDGFRBFGFR1
SCHEMBL3160871 0.80 KMT2A (0.41) PDPK1PIM1TGM2PDGFRBKDR
SCHEMBL3160648 0.79 PDPK1 (0.44) PDPK1PIM1TGM2KDRMAPK1
SCHEMBL3160654 0.79 PDPK1 (0.44) PDPK1PIM1TGM2KDRMAPK1
SCHEMBL3148743 0.77 PIM1 (0.46) PDPK1PIM1TGM2PDGFRBKDR
SCHEMBL7237107 0.76 RET (0.55) PDPK1TGM2TLK2
SCHEMBL2572615 0.76 FLT3 (0.42) PDPK1PIM1TGM2KDR
SCHEMBL2567808 0.74 TGM2 (0.38) PDPK1TGM2KDR
SCHEMBL3147662 0.72 SMN1; SMN2 (0.43) MAPK1
SCHEMBL3156413 0.71 IDO1 (0.42) PDPK1KDRMAPK1CHEK1

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
EP-1224170-B9 6-POSITION SUBSTITUTED INDOLINE, PRODUCTION AND USE THEREOF AS A MEDICAMENT BOEHRINGER INGELHEIM PHARMA (DE) 2017-11-22 EP disclosed
EP-2157081-A1 Indolinones substituted in six locations, their manufacture and their application as medicine Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2010-02-24 EP disclosed
EP-1224170-B1 6-POSITION SUBSTITUTED INDOLINE, PRODUCTION AND USE THEREOF AS A MEDICAMENT BOEHRINGER INGELHEIM PHARMA (DE) 2009-08-12 EP disclosed
US-6762180-B1 Substituted indolines which inhibit receptor tyrosine kinases BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-07-13 US disclosed
EP-1224170-A1 6-POSITION SUBSTITUTED INDOLINE, PRODUCTION AND USE THEREOF AS A MEDICAMENT Boehringer Ingelheim Pharma KG (DE) 2002-07-24 EP disclosed
WO-2001027081-A1 6-POSITION SUBSTITUTED INDOLINE, PRODUCTION AND USE THEREOF AS A MEDICAMENT BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-04-19 WO disclosed