SCHEMBL9249654

SCHEMBL9249654

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CASR P41180 3/20 0.34
▸ HTT P42858 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ GPR55 Q9Y2T6 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ CYP1A2 P05177 2/20 0.30
▸ TTR P02766 1/20 0.30
▸ CYP2C8 P10632 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ TSHR P16473 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
SCHEMBL9247971 0.80 CASR (0.32) TDP1TP53CASR
SCHEMBL9210994 0.80 ALDH1A1 (0.37) TDP1TP53CASRHTTSMN1; SMN2
SCHEMBL9246395 0.79 MAPT (0.33) TDP1TP53CASRALDH1A1MEN1
SCHEMBL11501560 0.77 TDP1 (0.41) TDP1TP53CASRHTTSMN1; SMN2
SCHEMBL15678402 0.76 TDP1 (0.41) TDP1TP53CASRHTTSMN1; SMN2
SCHEMBL19930764 0.76 TAAR1 (0.39) TDP1TP53CASRSMN1; SMN2ALDH1A1
SCHEMBL3815788 0.76 TDP1 (0.37) TDP1TP53CASRHTTSMN1; SMN2
SCHEMBL9943563 0.74 TDP1 (0.42) TDP1TP53CASRHTTSMN1; SMN2
SCHEMBL28027575 0.74 TDP1 (0.42) TDP1TP53CASRHTTSMN1; SMN2
SCHEMBL30859504 0.73 SMN1; SMN2 (0.39) TDP1TP53CASRHTTSMN1; SMN2

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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