SCHEMBL19252585

SCHEMBL19252585

OB(O)Oc1cccc2ccc3cc4ccccc4cc3c12.[CsH]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.40
ERBB2 P04626 1/20 0.40
FYN P06241 1/20 0.40
MAOA P21397 1/20 0.40
ACHE P22303 1/20 0.40
AHR P35869 1/20 0.40
ALDH1A1 P00352 8/20 0.37
GAA P10253 3/20 0.37
KDM4E B2RXH2 2/20 0.37
RXRA P19793 1/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
HSD17B10 Q99714 6/20 0.34
HPGD P15428 4/20 0.34
HIF1A Q16665 2/20 0.34
CYP1B1 Q16678 2/20 0.34
THRB P10828 1/20 0.34
NQO1 P15559 1/20 0.34
CA1 P00915 1/20 0.34

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
SCHEMBL19259375 0.98 CYP1A2 (0.41) CYP1A2ERBB2FYNMAOAACHE
Ammonia Solution, Strong SCHEMBL1035827 0.97 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
Phosphine SCHEMBL3288817 0.97 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
Iodide SCHEMBL3454480 0.97 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL1314570 0.97 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL73568 0.97 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL445634 0.97 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL911163 0.97 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
Hydrogen Sulfide SCHEMBL17372873 0.97 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL6740810 0.92 CYP1A2 (0.37) CYP1A2ERBB2FYNMAOAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118292105-A Multifunctional inorganic compound crystal and preparation method and application thereof 中国科学院福建物质结构研究所 2024-07-05 CN disclosed
EP-3988599-B1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND MITSUBISHI CHEM CORP (JP) 2023-10-18 EP disclosed
EP-3988599-A1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND Mitsubishi Chemical Corporation (JP) 2022-04-27 EP disclosed
US-20220081510-A1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-17 US disclosed
US-20180273748-A1 INTERIOR/EXTERIOR MEMBER FOR AUTOMOBILE MAZDA MOTOR CORPORATION (JP) 2018-09-27 US disclosed
US-20180094133-A1 INTERIOR/EXTERIOR AUTOMOTIVE TRIM COMPONENT MAZDA MOTOR CORPORATION (JP) 2018-04-05 US disclosed
US-20170240741-A1 INTERIOR/EXTERIOR AUTOMOBILE TRIM COMPONENT MAZDA MOTOR CORPORATION (JP) 2017-08-24 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 (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-20220081510-A1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND RTF1, RNF10, RAD51 CYP1A2 298/4885ERBB2 1766/4885FYN 2445/4885

“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.