SCHEMBL10733079

SCHEMBL10733079

S=C(COc1c(Cl)cccc1Cl)Nc1ncccn1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.42
▸ GAA P10253 3/20 0.39
▸ CYP2C19 P33261 1/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ MIF P14174 1/20 0.37

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
SCHEMBL10726989 0.81 NPSR1 (0.64) KMT2ANPSR1GAARAB9AALDH1A1
SCHEMBL10732207 0.81 NPSR1 (0.37) KMT2ASMN1; SMN2NPSR1GAARAB9A
SCHEMBL10729009 0.79 KDM4E (0.49) KMT2ASMN1; SMN2GAARAB9AALDH1A1
SCHEMBL10732212 0.75 ALDH1A1 (0.44) KMT2ASMN1; SMN2NPSR1CYP2C19RAB9A
SCHEMBL9722714 0.69 RAB9A (0.64) KMT2ASMN1; SMN2GAARAB9AALDH1A1
SCHEMBL5109846 0.68 KMT2A (0.65) KMT2ASMN1; SMN2GAAALDH1A1HPGD
SCHEMBL10732640 0.68 KMT2A (0.50) KMT2ARAB9AALDH1A1NPC1HPGD
SCHEMBL5638709 0.67 KMT2A (0.70) KMT2ASMN1; SMN2GAANPC1POLB
SCHEMBL7172967 0.66 KMT2A (0.74) KMT2AGAARAB9AALDH1A1NPC1
SCHEMBL3731079 0.66 GAA (0.56) KMT2AGAARAB9AALDH1A1NPC1

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-4672065-A TOMATO LATE BLIGHT CHEVRON RESEARCH COMPANY (US) 1987-06-09 — — US disclosed
US-4535087-A FOR TOMATO LATE BLIGHT CHEVRON RESEARCH COMPANY (US) 1985-08-13 — — US disclosed
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