SCHEMBL1728575

SCHEMBL1728575

O=C(c1ccccc1)C1C=CC=CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.43
ALOX15 P16050 2/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 1/20 0.39
HBB P68871 1/20 0.39
MCL1 Q07820 1/20 0.39
EPHX1 P07099 1/20 0.38
CA2 P00918 2/20 0.38
CA4 P22748 2/20 0.38
CES1 P23141 3/20 0.37
CES2 O00748 2/20 0.37
TSHR P16473 2/20 0.37
DAO P14920 1/20 0.37
NAPRT Q6XQN6 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA9 Q16790 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HDAC3 O15379 1/20 0.36

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
SCHEMBL18885175 0.82 NAPRT (0.39) ALOX15NAPRTALDH1A1HSD17B10L3MBTL1
SCHEMBL14211458 0.82 CA1 (0.42) ALOX15MAPTCA2CES1CES2
SCHEMBL13766454 0.82 MEN1 (0.42) MAPTHTTCES1CES2ALDH1A1
SCHEMBL11422590 0.78 GPR84 (0.42) GPR84MAPTTSHRALDH1A1HSD17B10
SCHEMBL9999676 0.78 GPR84 (0.40) GPR84RECQLBLM
SCHEMBL14299594 0.76 PTPN2 (0.39) GPR84TDP1
SCHEMBL13766474 0.76 MAPT (0.40) GPR84ALOX15MAPTTSHRALDH1A1
SCHEMBL17030331 0.76 TSHR (0.41) GPR84CA2CA4CES1CES2
SCHEMBL22020017 0.76 GPR84 (0.38) GPR84ALOX15CA2CA4CES1
SCHEMBL18071905 0.75 GPR84 (0.42) GPR84ALDH1A1TDP1

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 157 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106458847-B Novel diamine synthesis and liquid crystal aligning agent using the same 东进世美肯株式会社 2020-04-24 CN claimed
EP-2538410-B1 METHOD OF RECORDING DATA IN AN OPTICAL DATA STORAGE MEDIUM AND AN OPTICAL DATA STORAGE MEDIUM GEN ELECTRIC (US) 2016-08-10 EP claimed
EP-1727515-B1 UV ABSORBING CHROMOPHORES COVALENTLY BONDED TO HYPERBRANCHED POLYMERS DSM IP ASSETS BV (NL) 2014-04-30 EP claimed
US-20090069576-A1 PROCESS FOR PRODUCTION OF 1-(3-(2-(1-BENZOTHIOPHEN-5-YL)-ETHOXY)PROPYL)AZETIDIN-3-OL OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD (JP) 2009-03-12 US claimed
EP-1864978-A1 PROCESS FOR PRODUCTION OF 1-(3-(2-(1-BENZOTHIOPHEN-5-YL)- ETHOXY)PROPYL)AZETIDIN-3-OL OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2007-12-12 EP claimed
US-6540991-B2 Insect mating disruption pheromone formulation for controlling an insect pest 3M INNOVATIVE PROPERTIES COMPANY 2003-04-01 US claimed
US-20020146387-A1 STABILIZED ACTIVE MATERIALS 3M INNOVATIVE PROPERTIES COMPANY 2002-10-10 US claimed
EP-0492555-B1 Composition for the production of artificial marble or granite GREAT LAKES CHEMICAL ITALIA (IT) 1994-09-28 EP claimed
US-5118582-A PATTERN FORMING MATERIAL AND PROCESS FOR FORMING PATTERN USING THE SAME HITACHI, LTD. (JP) 1992-06-02 US claimed
EP-0437006-A1 Composition that protects dyed hair from fading Colgate-Palmolive Company (US) 1991-07-17 EP claimed
US-5028262-A Stabilization of ink compositions EASTMAN KODAK COMPANY (US) 1991-07-02 US claimed
EP-0164931-B1 PHOTOSENSITIVE MATERIALS AND IMAGING PROCESSES USING SUCH MATERIALS THE MEAD CORPORATION (US) 1990-10-03 EP claimed
US-4576891-A REDUCTION OF SPECTRUM SENSITIVITY IN MOCROCAPSULES OVERLAPPING SEGMENTS THE MEAD CORPORATION (US) 1986-03-18 US claimed
CN-119546989-A Light-transmitting resin composition, adhesive, optical film, and display device 赛登化学株式会社 2025-02-28 CN disclosed
CN-116057140-B Improvement of surface properties of radiation-cured coatings 毕克化学有限公司 2024-03-19 CN disclosed
US-11913593-B2 Blowable flexible innerduct MILLIKEN & COMPANY (US) 2024-02-27 US disclosed
US-4459376-A PHENOLIC RESIN, CARBONATE OR BICARBONATE SUMITOMO DUREZ COMPANY, LTD. (JP) 1984-07-10 US disclosed
US-4452926-A LUBRICANT-CONTAINING PHENOLIC RESINS AND ORGANIC CHLORIDE POLYMERS FOUNDRIES SUMITOMO DUREZ COMPANY, LTD. (JP) 1984-06-05 US disclosed
EP-0103213-A1 Solder and braze fluxes and processes for using the same International Business Machines Corporation (US) 1984-03-21 EP disclosed
US-4418161-A AROMATIC BROMIDE BINDER DEGRADERS SUMITOMO DUREZ COMPANY, LTD. (JP) 1983-11-29 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 (2 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-20090069576-A1 PROCESS FOR PRODUCTION OF 1-(3-(2-(1-BENZOTHIOPHEN-5-YL)-ETHOXY)PROPYL)AZETIDIN-3-OL OR SALTS THEREOF PMP22, ACOX1, PAOX GPR84 4347/4885ALOX15 255/4885MAPT 1262/4885
US-20020146387-A1 STABILIZED ACTIVE MATERIALS SHBG, BPHL, TES GPR84 3993/4885ALOX15 2194/4885MAPT 598/4885

“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.