SCHEMBL9312178

SCHEMBL9312178

Cc1cccc(NC2CCNC2)c1C

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.56
ATAD2 Q6PL18 5/20 0.56
HTR2C P28335 2/20 0.46
PRKCZ Q05513 1/20 0.43
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
ALOX12 P18054 1/20 0.42
PIM1 P11309 2/20 0.42
PIM2 Q9P1W9 2/20 0.42
BPTF Q12830 2/20 0.41
RAPGEF4 Q8WZA2 1/20 0.40
KDM1A O60341 1/20 0.39

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
SCHEMBL9310589 0.91 PRKCZ (0.53) BRD4ATAD2PRKCZLMNAGAA
SCHEMBL82566 0.90 BRD4 (0.55) BRD4ATAD2HTR2CLMNAGAA
Hydrochloric Acid SCHEMBL70439 0.89 HTR2C (0.54) BRD4ATAD2HTR2CLMNAGAA
SCHEMBL27322594 0.87 BRD4 (0.56) BRD4ATAD2HTR2CPRKCZPIM1
SCHEMBL27583230 0.77 PRKCZ (0.52) BRD4ATAD2PRKCZKDM1A
SCHEMBL27849930 0.76 GAA (0.62) LMNAGAAALOX12RAPGEF4
SCHEMBL82901 0.76 BRD4 (0.54) BRD4ATAD2HTR2CGAAPIM1
SCHEMBL29862480 0.75 HTR1A (0.52) BRD4ATAD2PRKCZPIM1PIM2
Hydrochloric Acid SCHEMBL68445 0.75 BRD4 (0.52) BRD4ATAD2HTR2CGAAPIM1
SCHEMBL21460267 0.74 PRKCZ (0.59) BRD4ATAD2PRKCZPIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5292738-A Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-08 US disclosed
US-5157035-A Viricides JANSSEN PHARMACEUTICA N. V. (BE) 1992-10-20 US disclosed
US-5001125-A Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-03-19 US disclosed
EP-0156433-B1 ANTI-VIRALLY ACTIVE PYRIDAZINAMINES JANSSEN PHARMACEUTICA N.V. (BE) 1991-02-27 EP disclosed
EP-0156433-A2 Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1985-10-02 EP disclosed