SCHEMBL7845288

SCHEMBL7845288

Nc1cc(-c2ccc(Cl)cc2)nc2ccnn12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.48
ALDH1A1 P00352 8/20 0.48
MEN1 O00255 8/20 0.48
KMT2A Q03164 8/20 0.48
MAPT P10636 8/20 0.48
LMNA P02545 2/20 0.48
CYP2C19 P33261 2/20 0.48
TP53 P04637 2/20 0.48
PDE10A Q9Y233 1/20 0.47
NPC1 O15118 6/20 0.43
RAB9A P51151 6/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
HPGD P15428 4/20 0.43
GAA P10253 2/20 0.43
CDK2 P24941 2/20 0.43
CHEK1 O14757 1/20 0.43
CCNA2 P20248 1/20 0.43
CCNA1 P78396 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 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
SCHEMBL7846570 0.84 ALDH1A1 (0.68) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL312516 0.84 PDE10A (0.64) KDM4EALDH1A1MAPTTP53PDE10A
SCHEMBL5452156 0.84 ALDH1A1 (0.56) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL7846516 0.84 RAD52 (0.51) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL1346973 0.81 PDE10A (0.47) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL5452103 0.81 KDM4E (0.56) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL7845119 0.79 ALDH1A1 (0.48) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL7849116 0.78 ALDH1A1 (0.51) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL1348546 0.78 PDE10A (0.44) KDM4EALDH1A1TP53PDE10ANPC1
SCHEMBL1348413 0.78 CCNE1 (0.44) KDM4EALDH1A1TP53PDE10ANPC1

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-0714898-B1 PYRAZOLO [1,5-a]PYRIMIDINE DERIVATIVE OTSUKA PHARMA CO LTD (JP) 2001-11-14 EP disclosed
US-5707997-A ANALGESICS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1998-01-13 US disclosed
EP-0714898-A1 PYRAZOLO [1,5-a]PYRIMIDINE DERIVATIVE OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1996-06-05 EP disclosed