SCHEMBL9726609

SCHEMBL9726609

CCCOc1cc(CNc2cnn(C(C)C)c(=O)c2Cl)ccc1OC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 2/20 0.46
BRD4 O60885 4/20 0.42
BRD9 Q9H8M2 3/20 0.42
POLB P06746 2/20 0.42
KMT2A Q03164 2/20 0.42
KAT2B Q92831 2/20 0.41
TSHR P16473 1/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
STAT1 P42224 1/20 0.38
CNR2 P34972 1/20 0.38
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE1C Q14123 1/20 0.38
PDE9A O76083 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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 0.92 BPTF (0.47) BPTFBRD4BRD9POLBKMT2A
SCHEMBL9726598 0.91 BPTF (0.52) BPTFBRD4BRD9POLBKMT2A
SCHEMBL9726861 0.89 POLB (0.41) BRD4BRD9POLBKMT2ATSHR
SCHEMBL9726652 0.89 THRB (0.39) POLBKMT2ATSHRMEN1THRB
SCHEMBL9726437 0.87 BPTF (0.50) BPTFBRD4BRD9POLBKMT2A
SCHEMBL9726673 0.86 BRD4 (0.46) BPTFBRD4BRD9POLBKMT2A
SCHEMBL9726869 0.86 BPTF (0.49) BPTFBRD4BRD9POLBKMT2A
SCHEMBL9726613 0.84 BPTF (0.49) BPTFBRD4BRD9POLBKMT2A
SCHEMBL9726565 0.83 BPTF (0.45) BPTFBRD4BRD9KMT2AKAT2B
SCHEMBL9726397 0.81 KDM4E (0.45) BRD4BRD9POLBKMT2ATSHR

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
US-5098900-A Reducing contractions in smooth muscles NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-03-24 US claimed
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 claimed
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 claimed
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