SCHEMBL4959595

SCHEMBL4959595

CCS(=O)(=O)NNCCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
ALDH1A1 P00352 3/20 0.49
LMNA P02545 2/20 0.49
CYP3A4 P08684 2/20 0.49
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
BLM P54132 1/20 0.49
GFER P55789 1/20 0.49
PMP22 Q01453 1/20 0.49
ATM Q13315 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
POLB P06746 1/20 0.47
IDO1 P14902 2/20 0.46
CA12 O43570 3/20 0.45
CA2 P00918 2/20 0.45
CA1 P00915 1/20 0.45
CA4 P22748 1/20 0.45
CA9 Q16790 2/20 0.44

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
SCHEMBL27504982 0.83 POLB (0.58) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL14719879 0.81 MEN1 (0.77) MEN1KMT2AALDH1A1LMNATAAR1
SCHEMBL7117183 0.79 ALDH1A1 (0.59) MEN1KMT2AALDH1A1LMNACYP3A4
Hydrochloric Acid SCHEMBL9270176 0.76 SIGMAR1 (0.50) MEN1KMT2ATAAR1POLBIDO1
SCHEMBL10395199 0.75 SMN1; SMN2 (0.64) ALDH1A1LMNACYP3A4KDM4EGAA
SCHEMBL11703182 0.75 CA1 (0.59) MEN1KMT2AALDH1A1KDM4ECA2
SCHEMBL28028806 0.74 MEN1 (0.90) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL9320464 0.74 ATM (0.58) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL22472095 0.74 ATM (0.58) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL27739790 0.73 HPGD (0.56) MEN1KMT2AALDH1A1CA12CA2

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-1984370-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Crystalgenomics, Inc. (KR) 2008-10-29 EP disclosed
WO-2007083978-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME CRYSTALGENOMICS, INC. (KR) 2007-07-26 WO disclosed