SCHEMBL901197

SCHEMBL901197

Nc1ccccc1C(c1ccccc1N)c1ccccc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.53
ALOX15 P16050 2/20 0.53
CASP1 P29466 1/20 0.53
CASP7 P55210 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ALDH1A1 P00352 6/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TSHR P16473 6/20 0.41
GAA P10253 3/20 0.40
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 3/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 3/20 0.38
HPGD P15428 2/20 0.38

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
SCHEMBL29438231 1.00 CYP3A4 (0.53) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL17221914 0.85 GAA (0.42) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL30589669 0.84 CYP3A4 (0.43) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL572997 0.84 CYP3A4 (0.43) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL4845351 0.84 CYP3A4 (0.43) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL7192114 0.83 TSHR (0.41) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL30602819 0.80 CYP3A4 (0.39) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL11241782 0.79 CYP3A4 (0.50) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL11774848 0.79 CYP3A4 (0.50) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL30365237 0.79 CYP3A4 (0.50) CYP3A4ALOX15CASP1CASP7SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0931280-B1 ELECTROPHOTOGRAPHIC CARRIER COMPOSITIONS HAVING IMPROVED LIFE NASHUA CORP (US) 2000-08-02 EP claimed
US-4196274-A REACTING A POLYSISCYANATE OR POLYISOTHIOCYANATE WITH A MALEAMIC ACID BAYER AKTIENGESELLSCHAFT (DE) 1980-04-01 US claimed
US-20260071042-A1 SYSTEMS AND METHODS FOR PRODUCING AEROGEL MATERIALS AEROGEL TECHNOLOGIES, LLC (US) 2026-03-12 US disclosed
US-20250340753-A1 THIN CORROSION PROTECTIVE COATINGS INCORPORATING POLYAMIDOAMINE POLYMERS HENKEL AG & CO KGAA (DE) 2025-11-06 US disclosed
US-12365812-B2 Thin corrosion protective coatings incorporating polyamidoamine polymers HENKEL AG & CO. KGAA (DE) 2025-07-22 US disclosed
US-20250136838-A1 POLYCARBONATE-BASED POLYURETHANE TOPCOATS PRC-DESOTO INTERNATIONAL, INC. (US) 2025-05-01 US disclosed
WO-2025038342-A1 DUAL CURE EPOXY COATINGS AND METHODS OF MAKING THE SAME SWIMC LLC (US) 2025-02-20 WO disclosed
CN-112703452-B Magenta toner and method for producing the same 日本瑞翁株式会社 2024-12-27 CN disclosed
US-20240425448-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUND, METHOD FOR PRODUCING CARBAMATE COMPOUND, METHOD FOR RECOVERING AMINE COMPOUND, AND ISOCYANATE COMPOSITION ASAHI KASEI KABUSHIKI KAISHA (JP) 2024-12-26 US disclosed
EP-4473028-A1 POLYCARBONATE-BASED POLYURETHANE TOPCOATS PRC-Desoto International, Inc. (US) 2024-12-11 EP disclosed
US-20240343877-A1 SYSTEMS AND METHODS FOR PRODUCING AEROGEL MATERIALS AEROGEL TECHNOLOGIES, LLC (US) 2024-10-17 US disclosed
US-4296218-A Heat-curable and solvent-soluble ester group-containing polymer compositions and process for their preparation TEIJIN LIMITED (JP) 1981-10-20 US disclosed
US-4281140-A REACTING AN ISOCYANATE OR ISOTHIOCYANATE WITH AN UNSATURATED DIAMINE BAYER AKTIENGESELLSCHAFT (DE) 1981-07-28 US disclosed
US-4251649-A COMPRISING A LOW MOLECULAR WEIGHT MODIFIER POLYESTER AND A POLYFUNCTIONAL HYDROXY OR AMINE TEIJIN LIMITED (JP) 1981-02-17 US disclosed
US-4228053-A Concrete preparation with aqueous solution of product from polyether with polymethylene polyphenyl polyisocyanate THE UPJOHN COMPANY (US) 1980-10-14 US disclosed
US-4220563-A Heat-curable and solvent-soluble ester group-containing polymer compositions and process for their preparation TEIJIN LIMITED (JP) 1980-09-02 US disclosed
US-4196274-A REACTING A POLYSISCYANATE OR POLYISOTHIOCYANATE WITH A MALEAMIC ACID BAYER AKTIENGESELLSCHAFT (DE) 1980-04-01 US disclosed
US-4182812-A FROM POLYISOCYANATES OR POLYISOTHIOCYANATES AND AN UNSATURATED DIAMIDE BAYER AKTIENGESELLSCHAFT (DE) 1980-01-08 US disclosed
US-4143014-A STORAGE STABLE SOLUTION OF POLYOXY-PROPYLENE OR ETHYLENE GLYCOL AND POLYMETHYLENEPOLYPHENYLENE POLYISOCYANATE THE UPJOHN COMPANY (US) 1979-03-06 US disclosed
US-4137221-A Heat-curable and solvent-soluble ester group-containing polymer compositions and process for their preparation TEIJIN LIMITED (JP) 1979-01-30 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 (2 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-20260071042-A1 SYSTEMS AND METHODS FOR PRODUCING AEROGEL MATERIALS TERT, TAF11, TAF1 CYP3A4 1834/4885ALOX15 3035/4885CASP1 725/4885
US-20240425448-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUND, METHOD FOR PRODUCING CARBAMATE COMPOUND, METHOD FOR RECOVERING AMINE COMPOUND, AND ISOCYANATE COMPOSITION IDH3A, CA7, C9 CYP3A4 182/4885ALOX15 1785/4885CASP1 112/4885

“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.