SCHEMBL5748611

SCHEMBL5748611

Cc1ccc(C(=O)N2CCC(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)C2)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 3/20 0.46
GRM5 P41594 1/20 0.46
LMNA P02545 1/20 0.45
MEN1 O00255 1/20 0.45
KDM5B Q9UGL1 1/20 0.45
VNN1 O95497 1/20 0.43
HPGDS O60760 2/20 0.42
CCNK O75909 1/20 0.42
CDK12 Q9NYV4 1/20 0.42
PDE2A O00408 1/20 0.42
USP2 O75604 1/20 0.41
PRKAB2 O43741 2/20 0.41
PRKAG1 P54619 2/20 0.41
PRKAA2 P54646 2/20 0.41
PRKAA1 Q13131 2/20 0.41
PRKAG3 Q9UGI9 2/20 0.41
PRKAG2 Q9UGJ0 2/20 0.41
PRKAB1 Q9Y478 2/20 0.41
DPP7 Q9UHL4 1/20 0.40

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
SCHEMBL3865263 1.00 ALDH1A1 (0.47) ALDH1A1KMT2AGRM5LMNAMEN1
SCHEMBL3861404 0.90 ALDH1A1 (0.55) ALDH1A1KMT2AGRM5LMNAMEN1
SCHEMBL3862880 0.89 ALDH1A1 (0.53) ALDH1A1KMT2AGRM5LMNAMEN1
SCHEMBL5746938 0.89 ALDH1A1 (0.53) ALDH1A1KMT2AGRM5LMNAMEN1
SCHEMBL5749702 0.89 PRKAA2 (0.45) ALDH1A1KMT2AGRM5LMNAMEN1
SCHEMBL3862481 0.89 PRKAA2 (0.45) ALDH1A1KMT2AGRM5LMNAMEN1
SCHEMBL3862507 0.86 HRH3 (0.48) ALDH1A1KMT2ALMNAMEN1KDM5B
SCHEMBL5745659 0.86 HRH3 (0.48) ALDH1A1KMT2ALMNAMEN1KDM5B
SCHEMBL3858189 0.84 ALDH1A1 (0.53) ALDH1A1KMT2AGRM5LMNAMEN1
SCHEMBL3857139 0.84 ALDH1A1 (0.48) ALDH1A1KMT2AGRM5LMNAMEN1

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 4 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
EP-1680415-A1 PYRROLIDINYL UREA DERIVATIVES AS ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2006-07-19 EP disclosed
WO-2005035524-A1 PYRROLIDINYL UREA DERIVATIVES AS ANGIOGENSIS INHIBITORS ABBOTT LABORATORIES (US) 2005-04-21 WO disclosed