SCHEMBL14191237

SCHEMBL14191237

CNc1cccnc1C(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 6/20 0.43
POLB P06746 2/20 0.43
BRD4 O60885 1/20 0.43
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
BLM P54132 1/20 0.41
AGER Q15109 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RRM2 P31350 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
MYC P01106 1/20 0.38

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
SCHEMBL3573444 0.85 KDM4E (0.55) KDM4EPOLBBRD4ATMTDP1
SCHEMBL20840585 0.83 MEN1 (0.58) MEN1KMT2AKDM4EPOLBBRD4
SCHEMBL16676649 0.83 POLB (0.45) KDM4EPOLBBRD4ATMTDP1
SCHEMBL15650965 0.83 MAP2K3 (0.50) KDM4EPOLBBRD4ATMTDP1
SCHEMBL1894761 0.81 L3MBTL1 (0.58) KDM4EPOLBBRD4ATMTDP1
SCHEMBL18428309 0.80 P2RX7 (0.51) KDM4EPOLBBRD4ATMTDP1
SCHEMBL20840514 0.79 GLO1 (0.55) MEN1KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL28361358 0.76 METAP1 (0.47) KDM4EPOLBBRD4ATMTDP1
SCHEMBL6449076 0.76 RRM2 (0.44) MEN1KMT2AKDM4EPOLBBRD4
SCHEMBL13211408 0.74 METAP1 (0.64) MEN1KMT2APOLBBRD4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7375119-B2 Amide type carboxamide derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-05-20 US disclosed
US-7375119-B2 Amide type carboxamide derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-05-20 US disclosed
EP-1816136-A1 GPR7-SELECTIVE LIGAND AND USE THEREOF BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-08 EP disclosed