SCHEMBL9656149

SCHEMBL9656149

O=C(Nc1ccccn1)c1snc(Cl)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.55
RAB9A P51151 8/20 0.55
KMT2A Q03164 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
GRM5 P41594 4/20 0.53
PKM P14618 1/20 0.50
MEN1 O00255 3/20 0.49
KCNMA1 Q12791 1/20 0.49
KDM4E B2RXH2 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
S1PR1 P21453 1/20 0.48
S1PR3 Q99500 1/20 0.48
MITF O75030 1/20 0.48
F2 P00734 1/20 0.48

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
SCHEMBL9655858 0.79 ALDH1A1 (0.51) NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL3571411 0.76 RAB9A (0.54) NPC1RAB9AKMT2ASMN1; SMN2MEN1
SCHEMBL23327873 0.75 F10 (0.72) NPC1RAB9AKMT2ASMN1; SMN2NFKB1
SCHEMBL31683829 0.75 F10 (0.72) NPC1RAB9AKMT2ASMN1; SMN2NFKB1
SCHEMBL9384187 0.74 NPC1 (0.72) NPC1RAB9AKMT2ASMN1; SMN2NFKB1
SCHEMBL4632412 0.72 KDM4E (0.50) NPC1RAB9AKMT2ASMN1; SMN2NPSR1
SCHEMBL10978860 0.72 RAB9A (0.86) NPC1RAB9AKMT2ASMN1; SMN2NPSR1
SCHEMBL12195635 0.71 NPC1 (0.59) NPC1RAB9AKMT2ASMN1; SMN2NFKB1
SCHEMBL10213140 0.71 KMT2A (0.40) NPC1RAB9AKMT2ASMN1; SMN2NPSR1
SCHEMBL16080074 0.71 USP2 (0.40) NPC1RAB9AKMT2ASMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5141552-A Applying isothiazole plant growth regulator to one variety, pollinating with another UNIVERSITY PATENTS, INC. (US) 1992-08-25 US claimed
EP-0302183-A2 Hybrid corn seed and method CHEMBRED, INC. (US) 1989-02-08 EP claimed
US-5141552-A Applying isothiazole plant growth regulator to one variety, pollinating with another UNIVERSITY PATENTS, INC. (US) 1992-08-25 US disclosed
EP-0302183-A2 Hybrid corn seed and method CHEMBRED, INC. (US) 1989-02-08 EP disclosed