SCHEMBL3258577

SCHEMBL3258577

CCc1cc(C(=O)O)ccc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
MRGPRX4 Q96LA9 1/20 0.51
TSHR P16473 3/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
ESR1 P03372 2/20 0.46
MYC P01106 1/20 0.46
ALOX15 P16050 1/20 0.46
PTPN7 P35236 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SLC22A12 Q96S37 1/20 0.46
TDP1 Q9NUW8 3/20 0.45
POLB P06746 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
NSD2 O96028 1/20 0.45

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
SCHEMBL27637429 0.88 MRGPRX4 (0.51) ALDH1A1MRGPRX4TSHRMEN1KMT2A
SCHEMBL2809375 0.86 MRGPRX4 (0.48) ALDH1A1MRGPRX4TSHRRXRASMN1; SMN2
SCHEMBL11427122 0.86 PKM (0.52) ALDH1A1MRGPRX4TSHRMEN1KMT2A
SCHEMBL27561164 0.84 ALDH1A1 (0.59) ALDH1A1MRGPRX4TSHRKMT2ARXRA
SCHEMBL20045101 0.84 MRGPRX4 (0.49) ALDH1A1MRGPRX4TSHRMEN1KMT2A
SCHEMBL2382916 0.84 MRGPRX4 (0.49) ALDH1A1MRGPRX4TSHRMEN1KMT2A
SCHEMBL7968434 0.84 MRGPRX4 (0.49) ALDH1A1MRGPRX4TSHRMEN1KMT2A
SCHEMBL7945742 0.84 MRGPRX4 (0.52) ALDH1A1MRGPRX4TSHRMEN1KMT2A
SCHEMBL2807448 0.83 RARB (0.51) ALDH1A1MRGPRX4TSHRMEN1KMT2A
SCHEMBL2054466 0.83 PKM (0.53) ALDH1A1TSHRMEN1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4818799-A COORDINATION CATALYST ALSO COMPRISING AN ALKYL-ALUMINUM-ANTIOXIDENT TO RELEASE THE ANTIOXIDANT IN SITU SHELL OIL COMPANY (US) 1989-04-04 US claimed
US-4276193-A MAGNESIUM DIHALIDE CARRIER, CATALYST COMPRISING AN ELECTRON DONOR, TITANIUM TETRACHLORIDE REDUCED WITH AN ORGANOALUMINUM HALIDE BAYER AKTIENGESELLSCHAFT (DE) 1981-06-30 US claimed
CN-112759528-B Imine ester compound and preparation method thereof 中国石油化工股份有限公司 2023-10-13 CN disclosed
CN-112759677-B Solid catalyst component for olefin polymerization, catalyst and application thereof 中国石油化工股份有限公司 2023-08-15 CN disclosed
CN-112759676-B Solid catalyst component for preparing polyolefin, catalyst and application thereof 中国石油化工股份有限公司 2023-08-15 CN disclosed
US-20230190946-A1 COMPOUNDS ZEALAND PHARMA A/S (DK) 2023-06-22 US disclosed
WO-2022085505-A1 METHOD OF PRODUCING Mg-CONTAINING PARTICLES 東邦チタニウム株式会社 2022-04-28 WO disclosed
US-11154556-B2 Methods of treating solid tumors with CCR2 antagonists CHEMOCENTRYX, INC. (US) 2021-10-26 US disclosed
US-10464934-B2 Substituted tetrahydropyrans as CCR2 modulators CHEMOCENTRYX, INC. (US) 2019-11-05 US disclosed
US-20190209573-A1 METHODS OF TREATING SOLID TUMORS WITH CCR2 ANTAGONISTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-07-11 US disclosed
US-20180098952-A1 INACTIVATORS OF TOXOPLASMA GONDII ORNITHINE AMINOTRANSFERASE FOR TREATING TOXOPLASMOSIS AND MALARIA NORTHWESTERN UNIVERSITY (US) 2018-04-12 US disclosed
US-4472524-A COORDINATION CATALYSTS MONTEDISON S.P.A. (IT) 1984-09-18 US disclosed
EP-0086471-A2 Components and catalysts for the polymerization of olefins Montedison S.p.A. (IT) 1983-08-24 EP disclosed
EP-0086472-A2 Catalyst for the polymerization of olefins Montedison S.p.A. (IT) 1983-08-24 EP disclosed
EP-0086473-A2 Components and catalysts for the polymerization of olefins Montedison S.p.A. (IT) 1983-08-24 EP disclosed
EP-0008764-B1 PROCESS FOR THE PREPARATION OF A CATALYST ON A SOLID CARRIER AND ITS USE IN THE POLYMERISATION OF PROPYLENE BAYER AG (DE) 1982-09-22 EP disclosed
US-4276193-A MAGNESIUM DIHALIDE CARRIER, CATALYST COMPRISING AN ELECTRON DONOR, TITANIUM TETRACHLORIDE REDUCED WITH AN ORGANOALUMINUM HALIDE BAYER AKTIENGESELLSCHAFT (DE) 1981-06-30 US disclosed
EP-0008764-A2 Process for the preparation of a catalyst on a solid carrier and its use in the polymerisation of propylene BAYER AG (DE) 1980-03-19 EP disclosed
US-4140859-A Dilithiated 2-(o-tolyl)-2-imidazolines SANDOZ, INC. (US) 1979-02-20 US disclosed
US-4101553-A Imidazo[2,1-a]isoquinolines SANDOZ, INC. (US) 1978-07-18 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 (5 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-10464934-B2 Substituted tetrahydropyrans as CCR2 modulators CCR2, CCR1, CCR5 ALDH1A1 1316/4885MRGPRX4 167/4885TSHR 722/4885
US-20190209573-A1 METHODS OF TREATING SOLID TUMORS WITH CCR2 ANTAGONISTS CCR2, CXCR2, CCRL2 ALDH1A1 3105/4885MRGPRX4 81/4885TSHR 356/4885
US-20180098952-A1 INACTIVATORS OF TOXOPLASMA GONDII ORNITHINE AMINOTRANSFERASE FOR TREATING TOXOPLASMOSIS AND MALARIA OAT, OTC, ABAT ALDH1A1 163/4885MRGPRX4 2928/4885TSHR 1613/4885
US-20230190946-A1 COMPOUNDS ITGB7, SCN7A, ITGB4 ALDH1A1 333/4885MRGPRX4 146/4885TSHR 2267/4885
US-11154556-B2 Methods of treating solid tumors with CCR2 antagonists CCR2, CXCR2, CCRL2 ALDH1A1 3105/4885MRGPRX4 81/4885TSHR 356/4885

“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.