SCHEMBL20177136

SCHEMBL20177136

CSSc1nnc(SSc2nnc(SSC)s2)s1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 4/20 0.48
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
CDK2 P24941 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 2/20 0.30

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
SCHEMBL4824062 0.97 FBP1 (0.43) FBP1KMT2AALDH1A1
SCHEMBL21897798 0.85 FBP1 (0.36) FBP1
SCHEMBL12313926 0.82 FBP1 (0.48) FBP1CDK1CCNB1CDK2KMT2A
SCHEMBL20177132 0.81
SCHEMBL4865603 0.81 FBP1 (0.42) FBP1KMT2AALDH1A1
SCHEMBL5181029 0.71
SCHEMBL17636797 0.71 FBP1 (0.38) FBP1
SCHEMBL3791857 0.71 GAA (0.48) FBP1ALDH1A1
SCHEMBL19311639 0.70 FBP1 (0.42) FBP1CDK1CCNB1CDK2
SCHEMBL16187285 0.70 NPC1 (0.46) FBP1ALDH1A1

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
US-20180142181-A1 Thiadiazole Components, Compositions, and Methods INTERNATIONAL PETROLEUM PRODUCTS & ADDITIVES COMPANY, INC. 2018-05-24 US disclosed