SCHEMBL10366709

SCHEMBL10366709

CCCCCc1c(Cl)cnn(C(C)(C)C)c1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.38
MAPK1 P28482 3/20 0.38
NPBWR1 P48145 1/20 0.38
SMN1; SMN2 Q16637 9/20 0.38
HTT P42858 4/20 0.38
CYP3A4 P08684 3/20 0.38
CYP2C9 P11712 3/20 0.38
CYP2C19 P33261 3/20 0.38
CYP2D6 P10635 2/20 0.38
CYP1A2 P05177 2/20 0.38
KMT2A Q03164 4/20 0.37
NPC1 O15118 3/20 0.37
MEN1 O00255 3/20 0.37
RAB9A P51151 2/20 0.37
LMNA P02545 2/20 0.37
GALR3 O60755 1/20 0.37
NR2F2 P24468 1/20 0.37
GPR183 P32249 1/20 0.37
GPR35 Q9HC97 1/20 0.37
TYMP P19971 3/20 0.36

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
SCHEMBL10367640 0.95 TSHR (0.39) TSHRMAPK1NPBWR1SMN1; SMN2HTT
SCHEMBL9726425 0.89 TSHR (0.40) TSHRMAPK1SMN1; SMN2HTTCYP3A4
SCHEMBL9726468 0.83 TSHR (0.41) TSHRMAPK1SMN1; SMN2HTTCYP3A4
SCHEMBL8542130 0.76 MAPK1 (0.39) TSHRMAPK1NPBWR1SMN1; SMN2HTT
SCHEMBL10374162 0.75 NPC1 (0.40) TSHRMAPK1SMN1; SMN2HTTCYP3A4
SCHEMBL3845405 0.74 SMN1; SMN2 (0.43) TSHRMAPK1SMN1; SMN2HTTCYP3A4
SCHEMBL23188748 0.71 TSHR (0.41) TSHRMAPK1SMN1; SMN2HTTCYP3A4
SCHEMBL11938603 0.70 SMN1; SMN2 (0.45) MAPK1NPBWR1SMN1; SMN2HTTCYP3A4
SCHEMBL9096210 0.69 MEN1 (0.70) MAPK1NPBWR1SMN1; SMN2HTTCYP3A4
SCHEMBL9775191 0.69 MEN1 (0.70) MAPK1NPBWR1SMN1; SMN2HTTCYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0193853-B1 3(2H)PYRIDAZINONE, PROCESS FOR ITS PREPARATION AND ANTI-ALLERGIC AGENT CONTAINING IT NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-09-12 EP disclosed
US-4783462-A 3(2H)pyridazinone, and anti-allergic agent containing it NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1988-11-08 US disclosed