SCHEMBL10375299

SCHEMBL10375299

CC(=O)c1c(C)nc(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.54
KDM4E B2RXH2 2/20 0.54
MAPK1 P28482 3/20 0.49
POLB P06746 3/20 0.49
NPSR1 Q6W5P4 4/20 0.47
MAPT P10636 3/20 0.47
AR P10275 1/20 0.46
ABCG2 Q9UNQ0 3/20 0.46
ABCB1 P08183 1/20 0.46
ABCC1 P33527 1/20 0.46
RAB9A P51151 4/20 0.44
ALDH1A1 P00352 3/20 0.44
MEN1 O00255 3/20 0.44
PKM P14618 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 2/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
NPC1 O15118 3/20 0.44
CYP1A2 P05177 2/20 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
SCHEMBL10376659 0.91 KMT2A (0.51) KMT2AKDM4EMAPK1POLBNPSR1
SCHEMBL10375355 0.88 ALDH1A1 (0.53) KMT2AKDM4EPOLBNPSR1MAPT
SCHEMBL10375291 0.85 KDM4E (0.59) KDM4EMAPK1NPSR1MAPTAR
SCHEMBL10375314 0.82 ABCG2 (0.51) KMT2AKDM4ENPSR1ABCG2ABCB1
SCHEMBL10377324 0.82 KMT2A (0.48) KMT2AKDM4ENPSR1MAPTABCG2
SCHEMBL10375337 0.81 USP2 (0.50) KMT2APOLBNPSR1MAPTALDH1A1
SCHEMBL10377355 0.80 KDM4E (0.61) KMT2AKDM4ENPSR1RAB9AALDH1A1
SCHEMBL10375340 0.80 TMEM97 (0.48) KMT2AKDM4EPOLBNPSR1MAPT
SCHEMBL10375313 0.79 KMT2A (0.49) KMT2AMAPK1POLBNPSR1MAPT
SCHEMBL10377358 0.79 NPC1 (0.50) KMT2APOLBMAPTABCG2ABCC1

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
EP-0169712-B1 NEW PYRIMIDINE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND COMPOSITION CONTAINING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-12-12 EP disclosed
US-4698340-A TREATMENT OF CEREBROVASCULAR DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-10-06 US disclosed
EP-0169712-A2 New pyrimidine derivatives, processes for preparation thereof and composition containing the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-29 EP disclosed