SCHEMBL9244669

SCHEMBL9244669

Cc1ccc(C(C)(C=C(Cl)Cl)C(C)C)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ GPR55 Q9Y2T6 1/20 0.35
▸ CASR P41180 3/20 0.33
▸ TP53 P04637 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ TRPA1 O75762 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ ADRA1A P35348 1/20 0.30
▸ HTR2B P41595 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) LMNAMAPTMEN1KMT2AGPR55
SCHEMBL9243122 0.76 TSHR (0.40) MAPTMEN1KMT2AALDH1A1
SCHEMBL9250737 0.74 CASR (0.33) LMNAMAPTMEN1KMT2AGPR55
SCHEMBL9244665 0.74 TRPA1 (0.37) TRPA1
SCHEMBL9249701 0.69 KCNN4 (0.33) MEN1KMT2AALDH1A1
SCHEMBL18242406 0.68 TDP1 (0.42) LMNAMAPTMEN1KMT2AGPR55
SCHEMBL9252948 0.67 CYP2D6 (0.39) MAPTKMT2AALDH1A1TRPA1
SCHEMBL11501560 0.67 TDP1 (0.41) LMNAMAPTMEN1KMT2AGPR55
SCHEMBL18546040 0.67 CASR (0.53) LMNAMAPTMEN1KMT2AGPR55
SCHEMBL12180439 0.67 TDP1 (0.46) LMNAMAPTMEN1KMT2AGPR55

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
Send feedback