SCHEMBL9250737

SCHEMBL9250737

CCC(C)(C=C(Cl)Cl)c1ccc(C)cc1C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 3/20 0.33
▸ TP53 P04637 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ GPR55 Q9Y2T6 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
SCHEMBL9250886 0.80 TP53 (0.38) CASRTP53TDP1SMN1; SMN2ALDH1A1
SCHEMBL9251651 0.76 TSHR (0.40) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL9250735 0.74 TRPA1 (0.37) MEN1KMT2ALMNAMAPT
SCHEMBL9244669 0.74 LMNA (0.35) CASRTP53TDP1ALDH1A1MEN1
SCHEMBL9220402 0.72 CASR (0.41) CASRTP53TDP1SMN1; SMN2ALDH1A1
SCHEMBL30859504 0.70 SMN1; SMN2 (0.39) CASRTP53TDP1SMN1; SMN2ALDH1A1
SCHEMBL12525117 0.70 TP53 (0.41) CASRTP53TDP1SMN1; SMN2ALDH1A1
SCHEMBL18242406 0.68 TDP1 (0.42) CASRTP53TDP1SMN1; SMN2ALDH1A1
SCHEMBL9247971 0.67 CASR (0.32) CASRTP53TDP1
Acetic Acid SCHEMBL29259035 0.67 CYP2C9 (0.37) CASRTDP1SMN1; SMN2ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0399284-B1 Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds BAYER AG (DE) 1995-08-02 — — EP disclosed
US-5136114-A PROCESS FOR THE PREPARATION OF GEMINAL DIARYLALKANES, NEW GEMINAL DIARYLALKANES AND ALK(EN)YLATED AROMATIC COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1992-08-04 — — US disclosed
EP-0399284-A2 Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds BAYER AG (DE) 1990-11-28 — — EP disclosed
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