SCHEMBL10464685

SCHEMBL10464685

OCc1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 6/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SCD O00767 3/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 2/20 0.37
MAPT P10636 2/20 0.37
TP53 P04637 2/20 0.37
LMNA P02545 1/20 0.37
PDE1A P54750 2/20 0.36
PDE1B Q01064 2/20 0.36
PDE1C Q14123 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL17596693 0.88 SCD (0.41) PDE5AKDM4EMEN1KMT2ASCD
SCHEMBL2786872 0.85 GAA (0.53) PDE5AKDM4EMEN1KMT2ASCD
SCHEMBL6584892 0.84 SMN1; SMN2 (0.45) PDE5AKDM4EMEN1KMT2ANPC1
SCHEMBL29530751 0.82 CSNK2A1 (0.50) PDE5AKDM4EMEN1KMT2ANPC1
SCHEMBL11091142 0.82 PDE5A (0.46) PDE5AKDM4EMEN1KMT2ANPC1
SCHEMBL10756603 0.82 PDE5A (0.46) PDE5AKDM4EMEN1KMT2ANPC1
SCHEMBL9813319 0.81 NPC1 (0.41) PDE5AKDM4EMEN1KMT2ANPC1
SCHEMBL10437870 0.81 PDE5A (0.39) PDE5AKDM4EMEN1KMT2ANPC1
SCHEMBL2786880 0.80 TP53 (0.59) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL27481508 0.79 PDE5A (0.43) PDE5AKDM4EMEN1KMT2AGAA

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-4933355-A ALDOSE REDUCTASE INHIBITORS SANKYO COMPANY LIMITED (JP) 1990-06-12 US disclosed
EP-0337819-A1 Thiazole derivatives, their preparation and their use in the treatment of diabetes complications Sankyo Company Limited (JP) 1989-10-18 EP disclosed