SCHEMBL6204686

SCHEMBL6204686

Cc1ccc(C(=O)Nc2cc(CCN3C(=O)N(c4ccc(C(F)(F)F)cc4S)C(=O)C3(C)C)ccn2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 12/20 0.45
NR3C2 P08235 3/20 0.40
SORT1 Q99523 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL2942056 0.92 IGF1R (0.53) IGF1R
SCHEMBL6204678 0.83 IGF1R (0.67) IGF1RNPC1RAB9A
SCHEMBL2941507 0.81 IGF1R (0.51) IGF1RHDAC1HDAC6KDM4E
SCHEMBL6204684 0.81 SORT1 (0.39) SORT1NPC1RAB9AKDM4EALDH1A1
SCHEMBL2934022 0.80 IGF1R (0.49) IGF1RNPC1RAB9ASMN1; SMN2HDAC1
SCHEMBL2943419 0.80 IGF1R (0.55) IGF1R
SCHEMBL2940677 0.80 IGF1R (0.55) IGF1R
SCHEMBL2941761 0.79 IGF1R (0.55) IGF1RALDH1A1
SCHEMBL2995898 0.78 IGF1R (0.51) IGF1RALDH1A1
SCHEMBL2990255 0.77 IGF1R (0.54) IGF1RNPC1RAB9A

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-1599464-A2 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2005-11-30 EP disclosed
WO-2004070050-A2 CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2004-08-19 WO disclosed