SCHEMBL11208640

SCHEMBL11208640

O=C(Nc1nnn[nH]1)c1ccc(OCCn2ccnc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 15/20 0.65
MEN1 O00255 1/20 0.60
LMNA P02545 1/20 0.60
KMT2A Q03164 1/20 0.60
GAA P10253 1/20 0.53
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
NOS1 P29475 1/20 0.50

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
SCHEMBL10751448 0.79 TBXAS1 (1.00) TBXAS1MEN1LMNAKMT2AGAA
SCHEMBL10749397 0.78 TBXAS1 (1.00) TBXAS1MEN1LMNAKMT2AGAA
SCHEMBL10750647 0.78 TBXAS1 (1.00) TBXAS1MEN1LMNAKMT2AGAA
SCHEMBL11405859 0.77 NPC1 (0.49) MEN1LMNAKMT2ASMN1; SMN2KDM4E
SCHEMBL10749342 0.77 TBXAS1 (0.72) TBXAS1MEN1LMNAKMT2AGAA
Dazoxiben SCHEMBL11554 0.76 TBXAS1 (1.00) TBXAS1MEN1LMNAKMT2AKDM4E
SCHEMBL10750806 0.76 TBXAS1 (0.63) TBXAS1MEN1LMNAKMT2AMAPK1
SCHEMBL8690701 0.76 TBXAS1 (0.75) TBXAS1MEN1LMNAKMT2AMAPK1
SCHEMBL10748630 0.76 TBXAS1 (0.74) TBXAS1MEN1LMNAKMT2AGAA
SCHEMBL8690308 0.75 TBXAS1 (0.78) TBXAS1MEN1LMNAKMT2AMAPK1

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-0035863-B1 IMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF Pfizer Limited (GB) 1983-10-26 EP claimed
US-4350696-A INHIBITORS OF THROMBOXANE SYNTHETASE ENZYME PFIZER INC. (US) 1982-09-21 US claimed
EP-0035863-B1 IMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF Pfizer Limited (GB) 1983-10-26 EP disclosed