SCHEMBL11451311

SCHEMBL11451311

N#CCSn1cnc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.46
▸ CYP11B1 P15538 3/20 0.41
▸ CYP11B2 P19099 3/20 0.41
▸ TNF P01375 1/20 0.41
▸ HTT P42858 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ MAPK1 P28482 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ AGER Q15109 1/20 0.37
▸ EGLN3 Q9H6Z9 1/20 0.37

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
SCHEMBL7491390 0.85 TDP1 (0.44) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL8792548 0.79 TDP1 (0.46) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL6530090 0.79 TDP1 (0.46) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL8413080 0.79 TDP1 (0.48) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL14722522 0.79 TDP1 (0.44) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL9060998 0.79 TDP1 (0.48) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL11140162 0.77 ASAH1 (0.47) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL10735469 0.77 TDP1 (0.43) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL6529410 0.76 CYP11B1 (0.53) TDP1CYP11B1CYP11B2TNFHTT
SCHEMBL20683088 0.76 TDP1 (0.48) TDP1CYP11B1CYP11B2TNFHTT

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-0006347-A1 Compositions and method for regulating soybean plant growth utilizing substituted benzazolylthioalkanoic acids MONSANTO COMPANY (US) 1980-01-09 — — EP disclosed
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