SCHEMBL837703

SCHEMBL837703

c1ccc([PH](CC[PH](c2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.36
CALM1 P0DP23 1/20 0.35
ALDH1A1 P00352 6/20 0.33
TRPA1 O75762 2/20 0.32
IDO1 P14902 1/20 0.32
TP53 P04637 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
MAPK1 P28482 2/20 0.31
HIF1A Q16665 2/20 0.31
GSK3B P49841 1/20 0.31
HTR2A P28223 1/20 0.31
HRH1 P35367 1/20 0.31
ALOX12 P18054 2/20 0.30
MAOB P27338 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
CASP1 P29466 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 2/20 0.30
CA12 O43570 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
SCHEMBL4309885 0.97 TSHR (0.35) TSHRCALM1ALDH1A1TRPA1IDO1
SCHEMBL1780038 0.97 TSHR (0.35) TSHRCALM1ALDH1A1TRPA1IDO1
SCHEMBL2441612 0.97 TSHR (0.35) TSHRCALM1ALDH1A1TRPA1IDO1
Hydrochloric Acid SCHEMBL1450025 0.94 TSHR (0.33) TSHRCALM1ALDH1A1
Hydrochloric Acid SCHEMBL1451305 0.94 TSHR (0.33) TSHRCALM1ALDH1A1
SCHEMBL3158018 0.89 TRPA1 (0.31) TSHRALDH1A1TRPA1MAPK1HIF1A
SCHEMBL1450028 0.89 ALDH1A1 (0.36) TSHRALDH1A1TRPA1MAPK1HIF1A
SCHEMBL838143 0.88 TSHR (0.39) TSHRCALM1ALDH1A1IDO1TDP1
SCHEMBL106258 0.88 TSHR (0.39) TSHRCALM1ALDH1A1IDO1TDP1
SCHEMBL12787151 0.85 TSHR (0.38) TSHRCALM1ALDH1A1ALOX12TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115710188-A Copper-based organic metal halide single crystal scintillator and preparation method and application thereof 中国科学院上海硅酸盐研究所 2023-02-24 CN claimed
EP-4118460-A1 X-RAY SCINTILLATORS, METAL HALIDE HYBRIDS, DEVICES, AND METHODS The Florida State University Research Foundation, Incorporated (US) 2023-01-18 EP claimed
WO-2021183855-A1 X-RAY SCINTILLATORS, METAL HALIDE HYBRIDS, DEVICES, AND METHODS The Florida State University Research Foundation, Inc. (US) 2021-09-16 WO claimed
US-20240174649-A1 CULLIN-RING E3 UBIQUITIN LIGASE 4 INHIBITOR COMPOUNDS AND METHODS OF THEIR USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2024-05-30 US disclosed
US-20230132026-A1 X-Ray Scintillators, Metal Halide Hybrids, Devices, and Methods NATIONAL SCIENCE FOUNDATION 2023-04-27 US disclosed
EP-4118460-A1 X-RAY SCINTILLATORS, METAL HALIDE HYBRIDS, DEVICES, AND METHODS The Florida State University Research Foundation, Incorporated (US) 2023-01-18 EP disclosed
WO-2022165432-A1 CULLIN-RING E3 UBIQUITIN LIGASE 4 INHIBITOR COMPOUNDS AND METHODS OF THEIR USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2022-08-04 WO disclosed
WO-2021183855-A1 X-RAY SCINTILLATORS, METAL HALIDE HYBRIDS, DEVICES, AND METHODS The Florida State University Research Foundation, Inc. (US) 2021-09-16 WO disclosed
US-9939729-B2 Resist pattern-forming method JSR CORPORATION (JP) 2018-04-10 US disclosed
EP-1398340-B1 BLOCK COPOLYMER AND POLYMERIC LUMINESCENT ELEMENT SUMITOMO CHEMICAL CO (JP) 2017-11-08 EP disclosed
US-9766547-B2 Pattern forming method, actinic ray-sensitive or radiation-sensitive resin composition, resist film, method of manufacturing electronic device using the same, and electronic device FUJIFILM CORPORATION (JP) 2017-09-19 US disclosed
US-20070042293-A1 Including an aromatic diphosphonium compound along with an addition polymerization promoter, unsaturated compound, protective layeron an sluminium support; laser recording having excellent ink receptibility during printing and printing durability; strength; on-press development; image strength FUJI PHOTO FILM CO., LTD. 2007-02-22 US disclosed
US-7125930-B2 Block copolymer and polymeric luminescent element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-24 US disclosed
US-6926973-B2 Copolymer, polymer composition and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-08-09 US disclosed
US-20040235667-A1 Pyrazolyl-substituted thienyloxypyridines BASF AKTIENGESELLSCHAFT (DE) 2004-11-25 US disclosed
US-20040198609-A1 4-alkyl-substituted thienyloxy-pyridines BASF AKTIENGESELLSCHAFT (DE) 2004-10-07 US disclosed
US-20040100804-A1 Solid pahse fluorescence; low molecular weight light emission diodes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-05-27 US disclosed
EP-1398340-A1 BLOCK COPOLYMER AND POLYMERIC LUMINESCENT ELEMENT Sumitomo Chemical Company, Limited (JP) 2004-03-17 EP disclosed
US-20030143429-A1 Copolymer, polymer composition and polymer light-emitting device SUMITOMO CHEMICAL COMPANY, LIMITED 2003-07-31 US disclosed
US-3864372-A Process for the production of unsaturated organosilicon compounds CESKOSLOVENSKA AKADEMIE VED 1975-02-04 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 (3 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-20040235667-A1 Pyrazolyl-substituted thienyloxypyridines HDHD5, CBR3, KCNH3 TSHR 206/4885CALM1 520/4885ALDH1A1 2329/4885
US-20240174649-A1 CULLIN-RING E3 UBIQUITIN LIGASE 4 INHIBITOR COMPOUNDS AND METHODS OF THEIR USE CUL4A, CUL1, CUL3 TSHR 4595/4885CALM1 2495/4885ALDH1A1 1864/4885
US-20040198609-A1 4-alkyl-substituted thienyloxy-pyridines CBR3, CBR1, HDHD5 TSHR 468/4885CALM1 623/4885ALDH1A1 2420/4885

“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.