SCHEMBL5747491

SCHEMBL5747491

Cc1ccc(C(=O)N2CCC(NC(=O)N3CCN(c4ccccc4F)CC3)C2)cn1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.50
KMT2A Q03164 3/20 0.49
KDM4E B2RXH2 1/20 0.47
ALOX15 P16050 1/20 0.47
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.45
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
PANK3 Q9H999 1/20 0.43
RAB9A P51151 1/20 0.42

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
SCHEMBL3857038 1.00 POLB (0.50) POLBKMT2AKDM4EALOX15ALDH1A1
SCHEMBL5748950 0.87 MEN1 (0.50) POLBKMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL3858172 0.87 MEN1 (0.50) POLBKMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL3866714 0.87 USP30 (0.54) POLBKMT2AALDH1A1SMN1; SMN2MAPK1
SCHEMBL5745163 0.85 PRKAA2 (0.49) POLBALDH1A1SMN1; SMN2
SCHEMBL3860102 0.85 PRKAA2 (0.49) POLBALDH1A1SMN1; SMN2
SCHEMBL5747603 0.84 KDM4E (0.53) POLBKMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL3863212 0.84 KDM4E (0.53) POLBKMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL5746938 0.83 ALDH1A1 (0.53) KMT2AALDH1A1MEN1LMNA
SCHEMBL3862880 0.83 ALDH1A1 (0.53) KMT2AALDH1A1MEN1LMNA

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-1680415-A1 PYRROLIDINYL UREA DERIVATIVES AS ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2006-07-19 EP claimed
WO-2005035524-A1 PYRROLIDINYL UREA DERIVATIVES AS ANGIOGENSIS INHIBITORS ABBOTT LABORATORIES (US) 2005-04-21 WO claimed