SCHEMBL8986865

SCHEMBL8986865

O=C(Nc1ccc(C(F)(F)F)cc1)Nn1cnc2ccccc2c1=O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.53
▸ MEN1 O00255 1/20 0.51
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ RAB9A P51151 4/20 0.50
▸ NPC1 O15118 4/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ MAPT P10636 3/20 0.49
▸ HTT P42858 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ LMNA P02545 3/20 0.48
▸ EPHX2 P34913 1/20 0.48
▸ CYP2D6 P10635 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ AURKA O14965 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ AURKB Q96GD4 1/20 0.47
▸ MTOR P42345 1/20 0.46

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
SCHEMBL8986852 0.87 SMN1; SMN2 (0.58) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL9323081 0.86 NAMPT (0.49) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL8986849 0.85 SMN1; SMN2 (0.54) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL9323136 0.85 SMN1; SMN2 (0.47) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL8986858 0.84 SMN1; SMN2 (0.53) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL8986883 0.84 KMT2A (0.70) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL8986845 0.84 SMN1; SMN2 (0.59) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL9321855 0.84 SMN1; SMN2 (0.46) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL8986838 0.81 NPC1 (0.62) KMT2AMEN1SMN1; SMN2RAB9ANPC1
SCHEMBL8986860 0.81 L3MBTL1 (0.72) KMT2AMEN1SMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0572782-B1 1-Aryl-3-(3,4-dihydro-4-oxo-3-quinazolinyl)-urea fungicidal agents AMERICAN CYANAMID CO (US) 1996-06-26 — — EP claimed
US-5276038-A 1-aryl-3-(3,4-dihydro-4-oxo-3-quinazolinyl)urea fungicidal agents AMERICAN CYANAMID COMPANY (US) 1994-01-04 — — US claimed
EP-0572782-A1 1-Aryl-3-(3,4-dihydro-4-oxo-3-quinazolinyl)-urea fungicidal agents AMERICAN CYANAMID COMPANY (US) 1993-12-08 — — EP claimed
JP-6056798-A — — None — — JP disclosed
EP-0572782-B1 1-Aryl-3-(3,4-dihydro-4-oxo-3-quinazolinyl)-urea fungicidal agents AMERICAN CYANAMID CO (US) 1996-06-26 — — EP disclosed
US-5354755-A Agricultural uses AMERICAN CYANAMID COMPANY (US) 1994-10-11 — — US disclosed
JP-H0656798-A 1-ARYL-3-(3,4-DIHYDRO-4-OXO-3-QUINAZOLINYL)UREA ANTIBACTERIAL AND FUNGICIDAL AGENT AMERICAN CYANAMID CO 1994-03-01 — — JP disclosed
US-5276038-A 1-aryl-3-(3,4-dihydro-4-oxo-3-quinazolinyl)urea fungicidal agents AMERICAN CYANAMID COMPANY (US) 1994-01-04 — — US disclosed
US-5276038-A 1-aryl-3-(3,4-dihydro-4-oxo-3-quinazolinyl)urea fungicidal agents AMERICAN CYANAMID COMPANY (US) 1994-01-04 — — US disclosed
EP-0572782-A1 1-Aryl-3-(3,4-dihydro-4-oxo-3-quinazolinyl)-urea fungicidal agents AMERICAN CYANAMID COMPANY (US) 1993-12-08 — — EP disclosed
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