SCHEMBL9518758

SCHEMBL9518758

O=C(O)c1c(O)cn2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.56
ALDH1A1 P00352 9/20 0.56
MAPT P10636 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
HPGD P15428 6/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
GAA P10253 4/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
PTGS2 P35354 2/20 0.42
PTGS1 P23219 1/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42

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
SCHEMBL2807005 0.81 ALDH1A1 (0.56) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL9518821 0.81 ALDH1A1 (0.65) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL3597471 0.80 KDM4E (0.55) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL30997233 0.79 KDM4E (0.80) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL28160835 0.75 KDM4E (0.54) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL3869652 0.73 KDM4E (1.00) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL28160833 0.72 ALDH1A1 (0.50) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL30997272 0.72 KDM4E (0.57) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL28161538 0.71 KDM4E (0.46) KDM4EALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL28145385 0.70 ALDH1A1 (0.46) KDM4EALDH1A1MAPTSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1026048-C Use of solsonylurea compounds as herbicide TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-10-05 CN disclosed
EP-0238070-B1 Sulfonylurea compounds, their production and herbicidal use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-29 EP disclosed
CN-1059073-A Solsonylurea compounds is as the purposes of weed killer herbicide TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1992-03-04 CN 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