Pyrazole

Pyrazole

SCHEMBL6854763

Brc1ccc(-n2cccn2)nc1.c1cn[nH]c1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
RXFP1 Q9HBX9 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2D6 P10635 1/20 0.38
CHRNA7 P36544 1/20 0.38
HPGD P15428 2/20 0.37
NPSR1 Q6W5P4 1/20 0.35
NPC1 O15118 1/20 0.35
GLA P06280 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CXCR4 P61073 1/20 0.35
KDM5B Q9UGL1 1/20 0.35
ACVR1B P36896 1/20 0.34
TGFBR1 P36897 1/20 0.34

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
SCHEMBL2067481 0.88 LMNA (0.57) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL23957686 0.69 KMT2A (0.44) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL3462062 0.68 LMNA (0.57) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL861501 0.68 LMNA (0.61) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL31516755 0.68 KDM4E (0.58) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL46317 0.68 KDM4E (0.58) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL3155897 0.68 LMNA (0.57) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL2728318 0.68 LMNA (0.57) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL22925970 0.68 LMNA (0.57) LMNAKMT2AKDM4EALDH1A1MEN1
SCHEMBL29696397 0.68 LMNA (0.57) LMNAKMT2AKDM4EALDH1A1MEN1

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-1453847-A1 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS Ortho-Mcneil Pharmaceutical, Inc. (US) 2004-09-08 EP disclosed
WO-2003050132-A1 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2003-06-19 WO disclosed