SCHEMBL7571745

SCHEMBL7571745

CC(C)(c1ccccc1Cl)c1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 3/20 0.48
TSHR P16473 4/20 0.47
LMNA P02545 2/20 0.47
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39
OPRK1 P41145 2/20 0.39
KCNH2 Q12809 2/20 0.39
ADRA1A P35348 1/20 0.39
ALDH1A1 P00352 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
KCNA3 P22001 2/20 0.36
HSD11B1 P28845 2/20 0.35
CYP1A2 P05177 4/20 0.35
CYP19A1 P11511 2/20 0.35
CA2 P00918 2/20 0.35
ADRB2 P07550 2/20 0.35
ADRB1 P08588 2/20 0.35
CYP2D6 P10635 2/20 0.35
NFKB1 P19838 2/20 0.35
HIF1A Q16665 2/20 0.35

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
SCHEMBL9577804 0.85 KCNN4 (0.57) KCNN4TSHRLMNAHTR2AHTR2C
SCHEMBL78489 0.83 TSHR (0.50) KCNN4TSHRLMNAHTR2AHTR2C
Benzene SCHEMBL28296949 0.81 KCNN4 (0.52) KCNN4TSHRLMNAHTR2AHTR2C
SCHEMBL6683028 0.81 KCNN4 (0.46) KCNN4TSHRLMNAHTR2AHTR2C
SCHEMBL6683582 0.81 KCNN4 (0.46) KCNN4TSHRLMNAHTR2AHTR2C
SCHEMBL28826593 0.81 KCNN4 (0.46) KCNN4TSHRLMNAHTR2AHTR2C
SCHEMBL803006 0.79 KCNN4 (0.45) KCNN4TSHRLMNAHTR2AHTR2C
SCHEMBL13617971 0.79 KCNN4 (0.45) KCNN4TSHRLMNAHTR2AHTR2C
SCHEMBL21302089 0.79 KCNN4 (0.45) KCNN4TSHRLMNAHTR2AHTR2C
SCHEMBL3092500 0.79 KCNN4 (0.45) KCNN4TSHRLMNAHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3984605-A Heat sensitive recording material containing decolorizing agent MITSUBISHI PAPER MILLS, LTD. (JA) 1976-10-05 US claimed
EP-0743190-B1 Color image forming method, color forming apparatus and color image RISO KAGAKU CORP (JP) 2002-09-25 EP disclosed
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
US-5024699-A Colorfast images; absorption in near-infrared RICOH COMPANY, LTD. (JP) 1991-06-18 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
US-4925828-A STABILITY; INFRARED ABSORBANCE RICOH COMPANY, LTD. (JP) 1990-05-15 US disclosed
EP-0127203-B1 NEW PHTHALIDE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND RECORDING SYSTEM UTILIZING THE SAME AS COLOURLESS CHROMOGENIC MATERIAL KANZAKI PAPER MANUFACTURING CO., LTD (JP) 1989-06-28 EP disclosed