SCHEMBL10662004

SCHEMBL10662004

COc1cc(C)nc2nc(S(=O)(=O)Nc3c(Cl)cccc3Cl)nn12

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
ALDH1A1 P00352 2/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.41
ALOX15 P16050 1/20 0.37
CCR4 P51679 1/20 0.36

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
SCHEMBL8356685 0.89 TSHR (0.46) TSHRCCR4
SCHEMBL8358900 0.88 TSHR (0.48) TSHRALDH1A1USP2LMNAALOX15
SCHEMBL8355504 0.87 TSHR (0.48) TSHRALDH1A1USP2LMNA
SCHEMBL7910513 0.86 TSHR (0.64) TSHRALDH1A1USP2LMNA
SCHEMBL10416986 0.86 TSHR (0.52) TSHRALDH1A1USP2LMNA
SCHEMBL8355405 0.85 TSHR (0.43) TSHRALDH1A1USP2LMNACCR4
SCHEMBL10667683 0.84 TSHR (0.50) TSHRALDH1A1USP2LMNA
SCHEMBL8355023 0.82 TSHR (0.48) TSHRALDH1A1USP2LMNA
SCHEMBL7850649 0.82 TSHR (0.41) TSHRCCR4
SCHEMBL10665580 0.81 TSHR (0.47) TSHRALDH1A1USP2

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-4734123-A HERBICIDE THE DOW CHEMICAL COMPANY (US) 1988-03-29 US disclosed