SCHEMBL7316586

SCHEMBL7316586

CCCc1ccc(-c2ccc(C(=O)Cl)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.56
PLK1 P53350 2/20 0.55
THRB P10828 2/20 0.53
ALDH1A1 P00352 3/20 0.53
POLB P06746 2/20 0.53
CTDSP1 Q9GZU7 2/20 0.53
MAPT P10636 2/20 0.53
KMT2A Q03164 2/20 0.53
KDM4E B2RXH2 1/20 0.53
GAA P10253 1/20 0.53
MEN1 O00255 1/20 0.53
RARA P10276 1/20 0.53
MTOR P42345 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
MCL1 Q07820 1/20 0.50
CNR2 P34972 1/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL1019681 0.94 PLK1 (0.60) RARBPLK1THRBALDH1A1POLB
SCHEMBL12656104 0.89 RARB (0.72) RARBPLK1THRBALDH1A1MAPT
SCHEMBL11554077 0.87 RARB (0.73) RARBTHRBALDH1A1MAPTKMT2A
SCHEMBL8103655 0.87 RARB (0.59) RARBPLK1THRBALDH1A1POLB
SCHEMBL9159711 0.86 RARB (0.73) RARBTHRBALDH1A1MAPTKMT2A
SCHEMBL8132083 0.86 RARB (0.73) RARBTHRBALDH1A1MAPTKMT2A
SCHEMBL6024252 0.86 RARB (0.73) RARBTHRBALDH1A1MAPTKMT2A
SCHEMBL9437181 0.86 RARB (0.73) RARBTHRBALDH1A1MAPTKMT2A
SCHEMBL10453829 0.86 RARB (0.73) RARBTHRBALDH1A1MAPTKMT2A
SCHEMBL7123177 0.84 ALDH1A1 (0.57) RARBPLK1ALDH1A1POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104592219-B Compound, optical film and method for making optical film 住友化学株式会社 2017-04-12 CN disclosed
CN-104592219-A Compound, optical film and method for making optical film SUMITOMO CHEMICAL CO 2015-05-06 CN disclosed
CN-101838264-B Compound, optical film, and method for producing optical film SUMITOMO CHEMICAL CO 2014-12-03 CN disclosed
US-20120273725-A1 Tetraoxybiphenyl Ester Chiral Dopants for Cholesteric Liquid Crystal Displays KENT STATE UNIVERSITY (US) 2012-11-01 US disclosed
CN-101838264-A Compound, optical film, and method for producing optical film SUMITOMO CHEMICAL CO 2010-09-22 CN disclosed
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed
EP-0805813-B1 TRICYCLIC VASOPRESSIN ANTAGONISTS AMERICAN CYANAMID CO (US) 2002-05-15 EP disclosed
US-5780471-A Tricyclic benzazepine vasopressin antagonists AMERICAN CYANAMID COMPANY (US) 1998-07-14 US disclosed
WO-1996022292-A1 TRICYCLIC VASOPRESSIN ANTAGONISTS AMERICAN CYANAMID COMPANY (US) 1996-07-25 WO disclosed
US-5521173-A TREATING DISEASES CHARACTERIZED BY EXCESS RENAL REABSORPTION OF WATER AMERICAN HOME PRODUCTS CORPORATION (US) 1996-05-28 US disclosed
US-5318721-A Nematic liquid-crystalline phases MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-06-07 US disclosed
US-4871469-A TRIFLUOROTOLUENE DERIVATIVES BESCRANKTER HAFTUNG (DE) 1989-10-03 US disclosed
US-4073742-A Cyano-substituted biphenyl compounds and liquid crystalline dielectrics containing the same MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1978-02-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120273725-A1 Tetraoxybiphenyl Ester Chiral Dopants for Cholesteric Liquid Crystal Displays DHCR7, CYP7A1, CCR7 RARB 1850/4885PLK1 3804/4885THRB 778/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.