SCHEMBL9341852

SCHEMBL9341852

COc1cc(CNC(=S)NCc2cc(C(C)(C)C)cc(C(C)(C)C)c2)ccc1OCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.45

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 0.94 LMNA (0.48) LMNA
SCHEMBL9850058 0.88 LMNA (0.46) LMNAALDH1A1TSHR
SCHEMBL8815820 0.85 LMNA (0.51) LMNAALDH1A1TSHR
SCHEMBL9850062 0.82 LMNA (0.44) LMNAALDH1A1TSHR
SCHEMBL9122701 0.82 LMNA (0.55) LMNAALDH1A1
SCHEMBL9340833 0.80
SCHEMBL8816740 0.75 TSHR (0.56) LMNAALDH1A1TSHR
SCHEMBL7940200 0.73
SCHEMBL15693964 0.72 ALDH1A1 (0.55) LMNAALDH1A1TSHR
SCHEMBL8814886 0.72 ALDH1A1 (0.59) ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0462933-B1 Novel N-benzyl-N1-phenyl and -phenalkyl-thioureas SANDOZ LTD (CH) 1994-06-08 EP disclosed
EP-0462933-A1 Novel N-benzyl-N1-phenyl and -phenalkyl-thioureas SANDOZ LTD. (CH) 1991-12-27 EP disclosed