SCHEMBL10648331

SCHEMBL10648331

CCc1nc(Cl)cc(NN)n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 3/20 0.37
PKM P14618 3/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.33
PPARA Q07869 1/20 0.32
HRH4 Q9H3N8 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
POLB P06746 1/20 0.31
POLA1 P09884 1/20 0.30

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
SCHEMBL9376957 0.82 NOS3 (0.36) GAAKMT2AKDM4ECYP2D6CYP2C19
SCHEMBL14689392 0.81 MAPT (0.42) GAAKMT2AMAPTPKMKDM4E
SCHEMBL1319508 0.79 KMT2A (0.38) GAAKMT2AKDM4ECYP2C19LMNA
SCHEMBL21539005 0.78 GAA (0.46) GAAKMT2AMAPTPKMKDM4E
SCHEMBL11680710 0.78 CDK2 (0.35) GAAKMT2AMAPTALDH1A1NPSR1
SCHEMBL10645996 0.77 CYP2D6 (0.33) GAAKMT2AMAPTPKMKDM4E
SCHEMBL11278078 0.75 CYP2D6 (0.61) GAAKMT2APKMKDM4EALDH1A1
SCHEMBL2721693 0.74 KMT2A (0.46) GAAKMT2AMAPTPKMKDM4E
SCHEMBL8112266 0.73 POLB (0.41) GAAKMT2AMAPTALDH1A1CYP2D6
SCHEMBL31373525 0.73 ALDH1A1 (0.41) GAAKMT2AMAPTPKMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0121341-B1 TRIAZOLO(4,3-C)PYRIMIDINES AND TRIAZOLO(1,5-C)PYRIMIDINES SUBSTITUTED BY NITROGEN-CONTAINING HETEROCYCLIC RINGS RIKER LABORATORIES, INCORPORATED (US) 1988-11-17 EP disclosed
US-4591588-A Triazolo[1,5-c]pyrimidines and bronchodilation use thereof RIKER LABORATORIES, INC. (US) 1986-05-27 US disclosed
US-4572910-A BRONCHODILATORS RIKER LABORATORIES, INC. (US) 1986-02-25 US disclosed
US-4536579-A BRONCHODILATING AGENTS RIKER LABORATORIES, INC. (US) 1985-08-20 US disclosed
US-4477450-A BRONCHODILATORS RIKER LABORATORIES, INC. (US) 1984-10-16 US disclosed
EP-0121341-A1 Triazolo(4,3-c)pyrimidines and triazolo(1,5-c)pyrimidines substituted by nitrogen-containing heterocyclic rings RIKER LABORATORIES, INCORPORATED (US) 1984-10-10 EP disclosed