SCHEMBL7985362

SCHEMBL7985362

O=c1nc(-c2cccc(Cl)c2)[nH]c2ncn(Cc3cccc(F)c3)c12

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GRIN1 Q05586 4/20 0.45
▸ GRIN2B Q13224 4/20 0.45
▸ POLB P06746 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ YTHDC1 Q96MU7 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ UBE2N P61088 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ACP1 P24666 2/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ PARN O95453 1/20 0.40
▸ CNOT7 Q9UIV1 1/20 0.40
▸ CXCR2 P25025 1/20 0.40
▸ P2RX7 Q99572 4/20 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
SCHEMBL7987312 0.96 GRIN1 (0.48) GRIN1GRIN2BPOLBTHRBYTHDC1
SCHEMBL7973628 0.93 SMN1; SMN2 (0.48) YTHDC1GLAHTTUBE2NSMN1; SMN2
SCHEMBL7991676 0.93 ACP1 (0.43) GRIN1GRIN2BACP1PARNCNOT7
SCHEMBL7988784 0.92 MAPK1 (0.43) GRIN1GRIN2BYTHDC1GLAHTT
SCHEMBL7974015 0.91 PARN (0.49) GLAHTTUBE2NSMN1; SMN2L3MBTL1
SCHEMBL7987255 0.90 PARN (0.48) GRIN1GRIN2BSMN1; SMN2ACP1MAPK1
SCHEMBL7985794 0.90 PARN (0.46) GRIN1GRIN2BSMN1; SMN2PARNCNOT7
SCHEMBL7985302 0.89 ROCK2 (0.41) GRIN1GRIN2BACP1PARNCNOT7
SCHEMBL7988820 0.89 MAPK1 (0.48) GRIN1GRIN2BYTHDC1GLAHTT
SCHEMBL7975243 0.88 HTT (0.44) GRIN1GRIN2BPOLBYTHDC1GLA

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
US-6310070-B1 FOR TREATING NEPHRITIS, IMPROVING PROTEINURIA DUE TO GLOMERULONEPHRITIS AND PREVENTING AGGRAVATION OF NEPHRITIS JAPAN ENERGY CORPORATION (JP) 2001-10-30 — — US disclosed
EP-0999211-A1 NOVEL PURINE DERIVATIVES AND MEDICINAL USE THEREOF JAPAN ENERGY CORPORATION (JP) 2000-05-10 — — EP disclosed
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