SCHEMBL28292387

SCHEMBL28292387

Cc1csc(NC(=O)CC(N)=O)n1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.64
RAB9A P51151 4/20 0.57
NPC1 O15118 3/20 0.57
MAPT P10636 2/20 0.57
TSHR P16473 3/20 0.55
POLB P06746 2/20 0.55
MAPK1 P28482 2/20 0.55
HSD17B10 Q99714 2/20 0.55
ALDH1A1 P00352 2/20 0.55
KDM4E B2RXH2 3/20 0.54
LMNA P02545 2/20 0.54
MAPK10 P53779 1/20 0.54
GLA P06280 1/20 0.53
USP2 O75604 1/20 0.53
ALOX15 P16050 1/20 0.53

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
SCHEMBL27224565 0.85 SMN1; SMN2 (0.66) SMN1; SMN2RAB9ANPC1MAPTTSHR
SCHEMBL20805209 0.85 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1MAPTTSHR
SCHEMBL19994399 0.84 SMN1; SMN2 (0.65) SMN1; SMN2RAB9ANPC1MAPTTSHR
SCHEMBL4097866 0.83 SMN1; SMN2 (0.63) SMN1; SMN2RAB9ANPC1MAPTTSHR
SCHEMBL839625 0.83 SMN1; SMN2 (0.63) SMN1; SMN2RAB9ANPC1MAPTTSHR
SCHEMBL3699546 0.82 MAPT (0.64) SMN1; SMN2RAB9ANPC1MAPTPOLB
SCHEMBL14706944 0.81 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1MAPTTSHR
SCHEMBL5335117 0.81 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1MAPTTSHR
SCHEMBL1358356 0.81 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1MAPTTSHR
SCHEMBL838537 0.81 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109715623-A 5- [2- (pyridin-2-ylamino) -1, 3-thiazol-5-yl ] -2, 3-dihydro-1H-isoindol-1-one derivatives and their use as dual inhibitors of phosphatidylinositol 3-kinase delta and gamma 阿斯利康(瑞典)有限公司 2019-05-03 CN disclosed