SCHEMBL7765253

SCHEMBL7765253

C=C(C)c1ccccc1I

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
PTPN2 P17706 2/20 0.35
PTPN1 P18031 2/20 0.35
PTPRF P10586 1/20 0.35
NPC1 O15118 1/20 0.33
CLCN2 P51788 1/20 0.33
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 1/20 0.31
TTR P02766 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
PAX8 Q06710 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL29712372 1.00 MEN1 (0.41) MEN1KMT2ATDP1PTPN2PTPN1
SCHEMBL29434165 0.81 MEN1 (0.40) MEN1KMT2ATDP1NPC1CLCN2
SCHEMBL107161 0.81 MEN1 (0.40) MEN1KMT2ATDP1NPC1CLCN2
SCHEMBL18242463 0.79 MEN1 (0.43) MEN1KMT2ATDP1PTPN2PTPN1
Hydrogen Peroxide SCHEMBL28416110 0.78 ALDH1A1 (0.43) MEN1KMT2ATDP1NPC1CLCN2
SCHEMBL30622076 0.78 MEN1 (0.39) MEN1KMT2ATDP1NPC1CLCN2
Hydrogen Sulfide SCHEMBL26644763 0.78 MEN1 (0.39) MEN1KMT2ATDP1NPC1CLCN2
SCHEMBL4426071 0.78 MEN1 (0.39) MEN1KMT2ATDP1NPC1CLCN2
Lithium SCHEMBL6003985 0.78 MEN1 (0.39) MEN1KMT2ATDP1NPC1CLCN2
SCHEMBL6003981 0.78 MEN1 (0.39) MEN1KMT2ATDP1NPC1CLCN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250034110-A1 LPAR1 ANTAGONISTS AND USES THEREOF Pipeline Therapeutics, Inc. 2025-01-30 US disclosed
CN-118043041-A LPAR1 antagonists and uses thereof 康蒂内乌姆医疗公司 2024-05-14 CN disclosed
US-20220348698-A1 COMPOUND, POLYMER, COMPOSITION, COMPOSITION FOR FILM FORMATION, PATTERN FORMATION METHOD, INSULATING FILM FORMATION METHOD, AND METHOD FOR PRODUCING COMPOUND, AS WELL AS METHOD FOR PRODUCING IODINE-CONTAINING VINYL POLYMER AND ACETYLATED DERIVATIVE THEREOF MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2022-11-03 US disclosed
CN-112321481-B Chiral indole compound and preparation method thereof 杭州师范大学 2022-06-10 CN disclosed
CN-114245792-A Compound, polymer, composition for film formation, method for pattern formation, method for forming insulating film, method for producing compound, and method for producing iodine-containing vinyl polymer and acetylated derivative thereof 三菱瓦斯化学株式会社 2022-03-25 CN disclosed
WO-2021029395-A1 COMPOUND, POLYMER, COMPOSITION, COMPOSITION FOR FILM FORMATION, PATTERN FORMING METHOD, METHOD FOR FORMING INSULATING FILM, METHOD FOR PRODUCING COMPOUND, IODINE-CONTAINING VINYL POLYMER AND METHOD FOR PRODUCING ACETYLATED DERIVATIVE OF SAME 三菱瓦斯化学株式会社 2021-02-18 WO disclosed
WO-2021029395-A1 COMPOUND, POLYMER, COMPOSITION, COMPOSITION FOR FILM FORMATION, PATTERN FORMING METHOD, METHOD FOR FORMING INSULATING FILM, METHOD FOR PRODUCING COMPOUND, IODINE-CONTAINING VINYL POLYMER AND METHOD FOR PRODUCING ACETYLATED DERIVATIVE OF SAME 三菱瓦斯化学株式会社 2021-02-18 WO disclosed
CN-112321481-A Chiral indole compound and preparation method thereof 杭州师范大学 2021-02-05 CN disclosed
WO-2008051532-A1 2-[1-PHENYL-5-HYDROXY OR METHOXY-4ALPHA-METHYL-HEXAHYDROCLOPENTA[F]INDAZOL-5-YL]ETHYL PHENYL DERIVATIVES AS GLUCOCORTICOID RECEPTOR LIGANDS MERCK & CO., INC. (US) 2008-05-02 WO disclosed
WO-2001092276-A1 PREPARATION OF PHOSPHINOARYLALKENES AND POLYMERS THEREOF CYTEC TECHNOLOGY CORP. (US) 2001-12-06 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-20250034110-A1 LPAR1 ANTAGONISTS AND USES THEREOF LPAR1, LPAR2, LPAR3 MEN1 2811/4885KMT2A 2605/4885TDP1 3301/4885

“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.