SCHEMBL10548838

SCHEMBL10548838

O=C(NCc1c(Cl)cccc1Cl)Nc1ccc(Cl)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.66
RAB9A P51151 8/20 0.60
NPC1 O15118 7/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
POLB P06746 1/20 0.59
NAMPT P43490 1/20 0.59
ROCK2 O75116 1/20 0.56
ROCK1 Q13464 1/20 0.56
ERCC1 P07992 1/20 0.56
ERCC4 Q92889 1/20 0.56
LSS P48449 1/20 0.55

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
SCHEMBL11027327 0.87 RAB9A (0.64) CNR1RAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL11030224 0.87 KMT2A (0.59) CNR1RAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL9428324 0.86 CNR1 (0.69) CNR1RAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL11031455 0.84 NPC1 (0.60) CNR1RAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL5638898 0.84 NAMPT (0.60) SMN1; SMN2KMT2AMEN1POLBNAMPT
SCHEMBL10545814 0.83 TAS1R3 (0.61) CNR1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL11051112 0.83 RAB9A (0.60) CNR1RAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL11205489 0.82 GCGR (0.64)
SCHEMBL8177097 0.80 RAB9A (0.72) CNR1RAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL11029084 0.80 NPC1 (0.53) CNR1RAB9ANPC1SMN1; SMN2KMT2A

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-4833151-A INTERFERES WITH METAMORPHOSES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1989-05-23 US disclosed
US-4438110-A 1-(MONO-SUBSTITUTED PHENYL)-3-BENZOYL UREA AND A PHOSPHOROUS CONTAINING COMPOUND UNION CARBIDE CORPORATION (US) 1984-03-20 US disclosed