Butanol

Butanol

SCHEMBL28118465

CCC(C)O.O=C1C=C(O)C(=O)N1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
XIAP P98170 1/20 0.32
KDM4E B2RXH2 1/20 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
SCHEMBL1029298 0.81
SCHEMBL28140618 0.78 XIAP (0.37) XIAP
Cyclohexane SCHEMBL1535470 0.74
SCHEMBL28120461 0.74 XIAP (0.31) XIAP
SCHEMBL17924957 0.71
SCHEMBL4821010 0.71 LMNA (0.33)
SCHEMBL17924861 0.70
Furan SCHEMBL28420762 0.68 MAPK1 (0.33)
SCHEMBL17924886 0.68
Methylcyclopentane SCHEMBL1535481 0.68 CA1 (0.32)

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-106413756-A Methods of using anti-STEAP 1 antibodies and immunoconjugates 豪夫迈·罗氏有限公司 2017-02-15 CN disclosed