SCHEMBL146927

SCHEMBL146927

Cc1ccccc1[P]c1ccccc1C

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.53
ACHE P22303 3/20 0.53
ALDH1A1 P00352 5/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
ESR1 P03372 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2A6 P11509 2/20 0.38
NQO2 P16083 1/20 0.36
LMNA P02545 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
TAAR1 Q96RJ0 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
Hydrochloric Acid SCHEMBL30984429 0.92 TSHR (0.45) TSHRACHEALDH1A1CA1CA2
Hydrochloric Acid SCHEMBL30984426 0.92 TSHR (0.45) TSHRACHEALDH1A1CA1CA2
Hydrochloric Acid SCHEMBL30984428 0.92 TSHR (0.45) TSHRACHEALDH1A1CA1CA2
SCHEMBL29042768 0.89 TSHR (0.43) TSHRACHEALDH1A1CA1CA2
Phosphine SCHEMBL28567213 0.89 TSHR (0.43) TSHRACHEALDH1A1CA1CA2
SCHEMBL6722506 0.77
SCHEMBL6722508 0.77
SCHEMBL5352487 0.77 TSHR (0.47) TSHRACHEALDH1A1CA1CA2
SCHEMBL8652711 0.77 TRPA1 (0.46) TSHRACHEALDH1A1CA1CA2
O-Xylene SCHEMBL11034038 0.71 TSHR (1.00) TSHRACHEALDH1A1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118515621-A Azolyl alcohol compound containing ethynyl and application thereof 沈阳药科大学 2024-08-20 CN disclosed
CN-114805430-A Preparation method of seleno-phosphide and thiophosphite 烟台大学 2022-07-29 CN disclosed
US-10230023-B2 Color converter BASF SE (DE) 2019-03-12 US disclosed
EP-2718395-B1 Novel illumination device comprising a colour converter BASF SE (DE) 2018-02-28 EP disclosed
US-20170174676-A1 CHLORINATED NAPTHALENETETRACARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2017-06-22 US disclosed
US-9583719-B2 Carbazolocarbazol-bis(dicarboximides) and their use as semiconductors BASF SE (DE) 2017-02-28 US disclosed
US-9512354-B2 Chlorinated naphthalenetetracarboxylic acid derivatives, preparation thereof and use thereof in organic electronics BASF SE (DE) 2016-12-06 US disclosed
US-20160284947-A1 NOVEL COLOR CONVERTER BASF SE (DE) 2016-09-29 US disclosed
US-9406848-B2 Color converter BASF SE (DE) 2016-08-02 US disclosed
EP-1951842-B1 USE OF RYLENE DERIVATIVES AS PHOTOSENSITIZERS IN SOLAR CELLS BASF SE (DE) 2016-07-27 EP disclosed
EP-1692149-A2 METHOD FOR PRODUCING ORTHOMETALATED AND ORTHOSUBSTITUTED AROMATIC COMPOUNDS Solvias AG (CH) 2006-08-23 EP disclosed
WO-2006037539-A1 HALOGENATION OF RYLEN-CARBOXIMIDES WITH ELEMENTARY HALOGEN IN A TWO-PHASE MIXTURE COMPRISING AN ORGANIC SOLVENT AND WATER, WHEREIN FORMED HALOGEN HYDROCIDE IS CONTINUOUSLY REMOVABLE FROM THE ORGANIC SOLVENT BASF AKTIENGESELLSCHAFT (DE) 2006-04-13 WO disclosed
WO-2006021307-A1 METHOD FOR PRODUCING QUATERRYLENE-3,4:13,14-TETRACARBOXY DIIMIDES BY DIRECT SYNTHESIS BASF AKTIENGESELLSCHAFT (DE) 2006-03-02 WO disclosed
WO-2005056566-A2 METHOD FOR PRODUCING ORTHOMETALATED AND ORTHOSUBSTITUTED AROMATIC COMPOUNDS SOLVIAS AG (CH) 2005-06-23 WO disclosed
EP-1532210-A1 RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2005-05-25 EP disclosed
WO-2004026965-A1 RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2004-04-01 WO disclosed
EP-1370612-A2 THERMOCHROMIC RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2003-12-17 EP disclosed
WO-2002068538-A2 THERMOCHROMIC RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2002-09-06 WO disclosed
EP-1206456-A1 THERMOCHROMIC RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2002-05-22 EP disclosed
WO-2001016109-A1 THERMOCHROMIC RYLENE DYES BASF AKTIENGESELLSCHAFT (DE) 2001-03-08 WO 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-20170174676-A1 CHLORINATED NAPTHALENETETRACARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN ORGANIC ELECTRONICS SLCO2A1, SLCO2B1, SLC43A3 TSHR 1739/4885ACHE 1774/4885ALDH1A1 1455/4885

“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.