SCHEMBL9850058

SCHEMBL9850058

COc1cc(CNC(=S)NCc2ccccc2C(C)(C)C)ccc1OCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL9340019 0.88 LMNA (0.48) LMNA
SCHEMBL9341852 0.88 LMNA (0.47) LMNAALDH1A1TSHR
SCHEMBL9850062 0.81 LMNA (0.44) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL9122701 0.81 LMNA (0.55) LMNAMEN1KMT2AALDH1A1MAPK1
SCHEMBL8815820 0.80 LMNA (0.51) LMNAMEN1KMT2AALDH1A1TSHR
SCHEMBL8816740 0.73 TSHR (0.56) LMNAALDH1A1TSHRMAPK1
SCHEMBL9340035 0.70 TSHR (0.50) LMNAALDH1A1TSHRMAPK1
SCHEMBL9140399 0.70 EPHX2 (0.67) MEN1KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL8813660 0.70 TSHR (0.52) LMNAALDH1A1TSHRMAPK1
SCHEMBL8813227 0.69 ALDH1A1 (0.46) LMNAMEN1KMT2AALDH1A1TSHR

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-0462933-A1 Novel N-benzyl-N1-phenyl and -phenalkyl-thioureas SANDOZ LTD. (CH) 1991-12-27 EP disclosed