SCHEMBL10980415

SCHEMBL10980415

Nc1ccc(Cl)nc1Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.53
CRHR2 Q13324 1/20 0.53
ADORA2A P29274 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
BCAT2 O15382 1/20 0.42
MAOA P21397 1/20 0.41
F10 P00742 2/20 0.41
PIN1 Q13526 2/20 0.41
F2 P00734 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
ST14 Q9Y5Y6 1/20 0.41
LTA4H P09960 1/20 0.39
TSHR P16473 1/20 0.39
MERTK Q12866 1/20 0.39
LMNA P02545 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
SCHEMBL20998690 0.79 CRHBP (0.55) CRHBPCRHR2CYP1A2CYP2C19MAOA
SCHEMBL10980250 0.78 CRHBP (0.53) CRHBPCRHR2ADORA2ACYP1A2CYP3A4
SCHEMBL12374084 0.78 ADORA2A (0.44) ADORA2ACYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL12620334 0.75 PIN1 (0.60) ADORA2ACYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL3207306 0.75 CRHBP (0.43) CRHBPCRHR2CYP1A2CYP2C19F10
SCHEMBL29193018 0.75 RAB9A (0.51) CRHBPCRHR2F10RAB9AKMT2A
SCHEMBL1309128 0.74 P2RY1 (0.36) CRHBPCRHR2CYP1A2CYP3A4CYP2C19
SCHEMBL16670718 0.73 BTK (0.53) CRHBPCRHR2F10RAB9AKMT2A
SCHEMBL16234979 0.72 CRHBP (0.41) CRHBPCRHR2CYP3A4TSHRMERTK
SCHEMBL29364510 0.72 CRHBP (0.41) CRHBPCRHR2CYP3A4TSHRMERTK

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-4504483-A Fluorine substituted pyridine methyl esters and insecticidal and acaricidal compositions thereof NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1985-03-12 US disclosed
US-4499275-A PESTICIDES; INSECTICIDES NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1985-02-12 US disclosed
US-4393213-A Process for producing 6-phenoxypicolinic aldehydes NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1983-07-12 US disclosed