SCHEMBL9246395

SCHEMBL9246395

Cc1ccc(C(C)(CC(Cl)(Cl)Cl)C(C)C)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ GPR55 Q9Y2T6 1/20 0.33
▸ CASR P41180 3/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL9249654 0.79 TDP1 (0.34) MAPTMEN1LMNAKMT2AGPR55
SCHEMBL9251103 0.75 TSHR (0.41) MAPTMEN1KMT2AALDH1A1TDP1
SCHEMBL9247971 0.75 CASR (0.32) CASRTP53TDP1
SCHEMBL9246388 0.73 TRPA1 (0.34) —
SCHEMBL11501560 0.72 TDP1 (0.41) MAPTMEN1LMNAKMT2AGPR55
SCHEMBL28027575 0.69 TDP1 (0.42) MAPTMEN1LMNAKMT2AGPR55
SCHEMBL9943563 0.69 TDP1 (0.42) MAPTMEN1LMNAKMT2AGPR55
SCHEMBL9246299 0.68 MEN1 (0.31) MEN1KMT2A
SCHEMBL9210994 0.67 ALDH1A1 (0.37) MAPTMEN1LMNAKMT2AGPR55
SCHEMBL114856 0.67 TDP1 (0.44) MAPTCASRALDH1A1POLBTP53

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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