SCHEMBL9517028

SCHEMBL9517028

FCc1cn2ccccc2n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 12/20 0.56
RAB9A P51151 12/20 0.56
SMN1; SMN2 Q16637 10/20 0.56
ALDH1A1 P00352 3/20 0.56
TP53 P04637 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KDM4E B2RXH2 5/20 0.55
MAPT P10636 1/20 0.54
PDE10A Q9Y233 1/20 0.54
MAPK1 P28482 1/20 0.54
SIRT5 Q9NXA8 1/20 0.54
HPGD P15428 2/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
TSHR P16473 2/20 0.52
LMNA P02545 3/20 0.51
HSD17B10 Q99714 2/20 0.50
HTR1A P08908 1/20 0.50
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50

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
SCHEMBL423547 0.81 NPC1 (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL7883973 0.81 NPC1 (0.55) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL758876 0.81 NPC1 (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL9570362 0.81 KDM4E (0.56) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL9043267 0.81 RAB9A (0.55) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL103805 0.81 NPC1 (0.58) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL5816677 0.81 NPC1 (0.55) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL859545 0.81 NPC1 (0.56) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL102061 0.81 KDM4E (0.56) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
Ammonia Solution, Strong SCHEMBL1764260 0.79 NPC1 (0.56) NPC1RAB9ASMN1; SMN2ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238070-B1 Sulfonylurea compounds, their production and herbicidal use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-29 EP disclosed
US-5017212-A For rice paddies TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US disclosed
EP-0238070-A2 Sulfonylurea compounds, their production and herbicidal use Takeda Chemical Industries, Ltd. (JP) 1987-09-23 EP disclosed