SCHEMBL6964358

SCHEMBL6964358

[O]C(=S)Nc1cccc(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.44
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 4/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
CES2 O00748 1/20 0.41
BCHE P06276 1/20 0.41
CES1 P23141 1/20 0.41
TP53 P04637 1/20 0.40
GAA P10253 1/20 0.40
PLA2G7 Q13093 1/20 0.40
NPSR1 Q6W5P4 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALOX12 P18054 1/20 0.39
ALPL P05186 1/20 0.39
ALPI P09923 1/20 0.39
ALPG P10696 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL28033909 0.83 ALDH1A1 (0.51) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL2089515 0.82 RAB9A (0.50) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL4256324 0.80 ALDH1A1 (0.40) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL20560687 0.80 ALDH1A1 (0.40) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL29838495 0.80 L3MBTL1 (0.50) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL5464387 0.80 L3MBTL1 (0.50) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL2089517 0.78 KMT2A (0.52) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL28822520 0.77 ALDH1A1 (0.49) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL6185781 0.76 RAB9A (0.53) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1
SCHEMBL9837431 0.76 RAB9A (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1MEN1

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed