SCHEMBL9726437

SCHEMBL9726437

CCOc1ccc(CNc2cnn(C(C)C)c(=O)c2Cl)cc1OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 2/20 0.50
BRD4 O60885 4/20 0.46
BRD9 Q9H8M2 3/20 0.46
KAT2B Q92831 3/20 0.45
MAPT P10636 4/20 0.42
POLB P06746 2/20 0.42
GAA P10253 2/20 0.42
TP53 P04637 1/20 0.42
NPBWR1 P48145 1/20 0.41
MCHR1 Q99705 1/20 0.41
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
PDE9A O76083 2/20 0.40
F2 P00734 1/20 0.39
F10 P00742 1/20 0.39
PRSS1 P07477 1/20 0.39
F7 P08709 1/20 0.39
CNR2 P34972 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 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
SCHEMBL10599611 0.95 BPTF (0.47) BPTFBRD4BRD9KAT2BMAPT
SCHEMBL9726609 0.87 BPTF (0.46) BPTFBRD4BRD9KAT2BPOLB
SCHEMBL9726598 0.87 BPTF (0.52) BPTFBRD4BRD9KAT2BMAPT
SCHEMBL10601786 0.86 BPTF (0.53) BPTFBRD4BRD9KAT2BTP53
SCHEMBL9726487 0.85 BRD4 (0.50) BPTFBRD4BRD9KAT2BMAPT
SCHEMBL9726528 0.84 BRD4 (0.52) BPTFBRD4BRD9KAT2BMAPT
SCHEMBL9726869 0.84 BPTF (0.49) BPTFBRD4BRD9KAT2BPOLB
SCHEMBL9726397 0.83 KDM4E (0.45) BRD4BRD9MAPTPOLBKDM4E
SCHEMBL9726540 0.82 KDM4E (0.44) MAPTPOLBGAAKDM4EALDH1A1
SCHEMBL9726613 0.82 BPTF (0.49) BPTFBRD4BRD9KAT2BMAPT

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
US-5098900-A Reducing contractions in smooth muscles NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-03-24 US disclosed
EP-0186817-B1 3(2H)PYRIDAZINONE, PROCESS FOR ITS PREPARATION AND ANTI-ALLERGIC AGENT CONTAINING IT NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1989-08-02 EP disclosed
EP-0186817-A1 3(2H)pyridazinone, process for its preparation and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1986-07-09 EP disclosed