SCHEMBL9521768

SCHEMBL9521768

Cc1cn2nc(SCc3ccccc3)sc2nc1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 8/20 0.55
POLB P06746 1/20 0.55
CDK2 P24941 1/20 0.53
CDK1 P06493 1/20 0.46
CCNB1 P14635 1/20 0.46
HTT P42858 5/20 0.44
ALDH1A1 P00352 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 2/20 0.42
GFER P55789 1/20 0.42
LMNA P02545 1/20 0.41
FFAR1 O14842 1/20 0.41
MAPK1 P28482 1/20 0.41
CHRNA7 P36544 1/20 0.40
F2RL3 Q96RI0 1/20 0.40
MAPT P10636 4/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL4291136 0.85 CDK2 (0.59) PKMPOLBCDK2CDK1CCNB1
SCHEMBL9776580 0.85 PKM (0.49) PKMPOLBCDK2CDK1CCNB1
SCHEMBL9523990 0.84 POLB (0.49) PKMPOLBCDK2CDK1CCNB1
SCHEMBL10373443 0.82 NPC1 (0.57) PKMPOLBCDK2CDK1CCNB1
SCHEMBL9776504 0.82 POLB (0.46) PKMPOLBCDK2CDK1CCNB1
SCHEMBL9533385 0.81 F2RL3 (0.51) PKMALDH1A1SMN1; SMN2HPGDF2RL3
SCHEMBL9523145 0.78 PKM (0.59) PKMPOLBCDK2CDK1CCNB1
SCHEMBL9776545 0.78 PKM (0.52) PKMPOLBCDK2CDK1CCNB1
SCHEMBL11339038 0.78 TP53 (0.61) PKMPOLBCDK2CDK1CCNB1
SCHEMBL4291301 0.78 CDK2 (0.50) PKMPOLBCDK2CDK1CCNB1

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
JP-63045286-A None JP disclosed
EP-0242690-B1 5H-1,3,4-Thiadiazolo[3,2-a]pyrimidin-5-one derivatives and agricultural-horticultural fungicide composition containing the same KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1993-06-30 EP disclosed
US-4985432-A 5H-1,3,4-thiadiazolo(3,2-A)pyrimidin-5-one derivatives and agricultural-horticultural fungicide composition containing the same KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1991-01-15 US disclosed
JP-S6345286-A 5H-1,3,4-THIADIAZOLO(3,2-A)PYRIMIDIN-5-ONE DERIVATIVE AND AGRICULTURAL AND HORTZCULTURAL GERMICIDE CONTAINING SAID COMPOUND AS ACTIVE INGREDIENT KUMIAI CHEM IND CO LTD 1988-02-26 JP disclosed
EP-0242690-A2 5H-1,3,4-Thiadiazolo[3,2-a]pyrimidin-5-one derivatives and agricultural-horticultural fungicide composition containing the same KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1987-10-28 EP disclosed