SCHEMBL2090405

SCHEMBL2090405

COS(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 3/20 0.41
HTR6 P50406 2/20 0.41
PSIP1 O75475 1/20 0.40
TSHR P16473 3/20 0.38
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA3 P07451 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
PLA2G7 Q13093 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
CA5B Q9Y2D0 1/20 0.38

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
SCHEMBL28144649 0.90 HTR6 (0.35) CA4HTR6PSIP1TSHRCA12
SCHEMBL28212310 0.77 CA4 (0.41) CA4HTR6PSIP1TSHRCA12
SCHEMBL22263422 0.77 CA4 (0.41) CA4HTR6PSIP1TSHRCA12
SCHEMBL26136335 0.75 HTR6 (0.45) CA4HTR6PSIP1TSHRCA12
SCHEMBL5828197 0.74 CA4 (0.39) CA4HTR6PSIP1TSHRCA12
SCHEMBL94530 0.72 HTR6 (0.50) CA4HTR6PSIP1TSHRCA12
SCHEMBL21647647 0.72 TSHR (0.46) CA4HTR6PSIP1TSHRCA12
SCHEMBL5607138 0.71 HTR6 (0.47) CA4HTR6PSIP1TSHRCA12
SCHEMBL2293678 0.70 HTR6 (0.36) CA4HTR6PSIP1TSHRCA12
SCHEMBL614636 0.70 HTR6 (0.48) CA4HTR6PSIP1TSHRCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4188274-A1 3D PRINTED COMPOSITES FROM PHASE SEPARATED MATERIALS Align Technology, Inc. (US) 2023-06-07 EP disclosed
WO-2021039799-A1 CURABLE COMPOSITION 株式会社日本触媒 2021-03-04 WO disclosed
EP-3613070-A1 PHOTOACTIVE, INORGANIC LIGAND-CAPPED INORGANIC NANOCRYSTALS The University of Chicago (US) 2020-02-26 EP disclosed
WO-2019007512-A1 ABSORBENT ARTICLE COMPRISING A MONOLITHIC ABSORBENT STRUCTURE COMPRISING A HYDROGEL-FORMING MATERIAL ESSITY HYGIENE AND HEALTH AKTIEBOLAG (SE) 2019-01-10 WO disclosed
CN-103687863-A Compounds containing alkyl-cyano-borate or alkyl-cyano-fluoroborate anions MERCK PATENT GMBH 2014-03-26 CN disclosed
US-8163462-B2 Photosensitive composition, method for forming pattern, and method for manufacturing semiconductor device RENESAS ELECTRONICS CORPORATION (JP) 2012-04-24 US disclosed
EP-2255401-A1 NONWOVEN FABRIC HAVING CROSS-LINKING MATERIAL Carl Freudenberg KG (DE) 2010-12-01 EP disclosed
US-20090317742-A1 Photosensitive composition, method for forming pattern, and method for manufacturing semiconductor device NEC ELECTRONICS CORPORATION (JP) 2009-12-24 US disclosed
WO-2009103537-A1 NONWOVEN FABRIC HAVING CROSS-LINKING MATERIAL CARL FREUDENBERG KG (DE) 2009-08-27 WO disclosed
US-6183934-B1 FOE USE IN FORMATION OF PATTERN OF INSULATION FILM, PASSIVATION FILM, .ALPHA.-RAY SHIELDING FILM, OPTICAL WAVEGUIDE KABUSHIKI KAISHA TOSHIBA (JP) 2001-02-06 US disclosed