SCHEMBL5744752

SCHEMBL5744752

Cc1ccc(C(=O)N2CCC(N)C2)cn1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.55
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.52
MEN1 O00255 1/20 0.52
GRM5 P41594 3/20 0.51
PDE2A O00408 1/20 0.50
KDM1A O60341 5/20 0.47
KCNH2 Q12809 1/20 0.47
L3MBTL3 Q96JM7 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
VNN1 O95497 1/20 0.43

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
SCHEMBL5909143 1.00 ALDH1A1 (0.55) ALDH1A1KMT2ALMNAMEN1GRM5
SCHEMBL3857604 1.00 ALDH1A1 (0.55) ALDH1A1KMT2ALMNAMEN1GRM5
SCHEMBL14731432 0.92 ALDH1A1 (0.61) ALDH1A1KMT2ALMNAMEN1GRM5
Trifluoroacetic Acid SCHEMBL3857570 0.92 KCNH2 (0.48) ALDH1A1KMT2ALMNAMEN1GRM5
SCHEMBL2431433 0.92 GRM5 (0.53) ALDH1A1KMT2ALMNAMEN1GRM5
SCHEMBL12426729 0.84 KCNH2 (0.50) GRM5KDM1AKCNH2L3MBTL3L3MBTL1
SCHEMBL26944349 0.84 GRM5 (0.54) ALDH1A1KMT2ALMNAMEN1GRM5
SCHEMBL5908999 0.84 ALDH1A1 (0.61) ALDH1A1KMT2ALMNAMEN1GRM5
SCHEMBL26421666 0.83 KCNH2 (0.44) GRM5KDM1AKCNH2L3MBTL3L3MBTL1
SCHEMBL26421617 0.83 ALDH1A1 (0.47) ALDH1A1GRM5KDM1AKCNH2L3MBTL3

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 disclosed
WO-2005035524-A1 PYRROLIDINYL UREA DERIVATIVES AS ANGIOGENSIS INHIBITORS ABBOTT LABORATORIES (US) 2005-04-21 WO disclosed