SCHEMBL9726412

SCHEMBL9726412

CN(C)c1ccc(CNc2cnn(C(C)(C)C)c(=O)c2Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 7/20 0.53
BRD9 Q9H8M2 5/20 0.53
KAT2B Q92831 6/20 0.52
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
GALR3 O60755 1/20 0.44
NR2F2 P24468 1/20 0.44
GPR183 P32249 1/20 0.44
GPR35 Q9HC97 1/20 0.44
BPTF Q12830 4/20 0.43
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
GAA P10253 2/20 0.40

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
Hydrochloric Acid SCHEMBL9726406 0.99 BRD4 (0.52) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL9726461 0.84 BRD4 (0.49) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL9726805 0.82 BRD4 (0.53) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL9726479 0.81 BRD4 (0.50) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL21442514 0.76 BRD4 (0.47) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL9726537 0.76 BRD4 (0.45) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL17074608 0.74 CNR2 (0.56) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL9726566 0.73 LMNA (0.47) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL9726748 0.73 BRD4 (0.43) BRD4BRD9KAT2BMEN1KMT2A
SCHEMBL10871305 0.72 BRD4 (0.42) BRD4BRD9KAT2BMEN1KMT2A

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