SCHEMBL374656

SCHEMBL374656

COc1cc(Cc2ccc(N=C=O)c(OC)c2)ccc1N=C=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
CYP3A4 P08684 4/20 0.67
HPGD P15428 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
CA2 P00918 1/20 0.53
GAA P10253 3/20 0.44
TSHR P16473 3/20 0.44
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41
TUBA3E Q6PEY2 1/20 0.41
TUBA1A Q71U36 1/20 0.41
TUBA1C Q9BQE3 1/20 0.41
TUBB6 Q9BUF5 1/20 0.41

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
SCHEMBL11668310 0.92 CYP3A4 (0.59) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL181315 0.92 CYP3A4 (0.59) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL16313427 0.91 ALDH1A1 (0.56) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL17787467 0.90 CYP3A4 (0.67) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL19308541 0.87 CYP3A4 (0.63) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL1071456 0.86 CA2 (0.53) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL1683896 0.85 CYP3A4 (0.54) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL16278989 0.85 ALDH1A1 (0.54) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL738462 0.85 CYP3A4 (0.61) ALDH1A1CYP3A4HPGDTDP1CA2
SCHEMBL5655051 0.85 ALDH1A1 (0.50) ALDH1A1CYP3A4HPGDTDP1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7935779-B2 Synthesis of polyimides (PI) from poly-carbodiimides and dianhydrides by sequential self-repetitive reaction (SSRR) GREAT EASTERN RESINS INDUSTRIAL CO., LTD. (TW) 2011-05-03 US claimed
US-20090012242-A1 SYNTHESIS OF POLYIMIDES (PI) FROM POLY-CARBODIIMIDES AND DIANHYDRIDES BY SEQUENTIAL SELF-REPETITIVE REACTION (SSRR) GREAT EASTERN RESINS INDUSTRIAL CO., LTD. (TW) 2009-01-08 US claimed
US-6235367-B1 MOLDED CONSTRUCTION WALLS WITH RESIN MATRICES, CATALYSTS, FILLERS, FOAMING CORES AND CURING AGENTS Holmes, Robert D. 2001-05-22 US claimed
US-5389490-A Capsule toner and process for producing the same FUJI XEROX CO., LTD. (JP) 1995-02-14 US claimed
US-4664979-A DURABLE MAGNETIC TAPES FUJI PHOTO FILM CO., LTD. (JP) 1987-05-12 US claimed
US-4321350-A Process for the catalytic setting of polyurethane molding compositions GAMBRO DIALYSATOREN KG (DE) 1982-03-23 US claimed
US-20230295389-A1 PREPREG, MOLDED ARTICLE AND EPOXY RESIN COMPOSITION MITSUBISHI CHEMICAL CORPORATION (JP) 2023-09-21 US disclosed
EP-4245783-A1 PREPREG, MOLDED ARTICLE AND EPOXY RESIN COMPOSITION Mitsubishi Chemical Corporation (JP) 2023-09-20 EP disclosed
US-20220175632-A1 OIL-IN-WATER EMULSION COSMETIC SHISEIDO COMPANY, LTD. (JP) 2022-06-09 US disclosed
CN-110997851-B Allyl-functionalized urethane oligomers and related compositions for coatings and adhesives 阿科玛法国公司 2022-06-07 CN disclosed
US-20220160615-A1 COSMETIC, COSMETIC FOR USE IN WARMED STATE, AND BEAUTY METHOD SHISEIDO COMPANY, LTD. (JP) 2022-05-26 US disclosed
US-11261288-B2 Allyl functional urethane oligomers and related compositions for coatings and adhesives ARKEMA FRANCE (FR) 2022-03-01 US disclosed
US-20210403701-A1 CURABLE RESIN COMPOSITION, AND FILM, MOLDED ARTICLE, PREPREG, AND FIBER-REINFORCED PLASTIC USING SAID CURABLE RESIN COMPOSITION MITSUBISHI CHEMICAL CORPORATION (JP) 2021-12-30 US disclosed
US-4056579-A Novel thermosetting resin composition and cured product therefrom HITACHI, LTD. (JA) 1977-11-01 US disclosed
US-4049871-A POLYURETHANE, ALKYD RESIN, POLYISOCYANATE BINDER FUJI PHOTO FILM CO., LTD. (JA) 1977-09-20 US disclosed
US-4032574-A PRODUCTION OF POLYETHERPOLYOLS USEFUL IN PREPARING RIGID POLYURETHANE FOAMS TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1977-06-28 US disclosed
US-4008192-A Polyisocyanates blocked with hydroxamic acid esters or acyl hydroxamates AKZO N.V. (NL) 1977-02-15 US disclosed
US-3984376-A Thermosetting resin compositions prepared from isocyanates and epoxyphenols HITACHI, LTD. (JA) 1976-10-05 US disclosed
US-3979365-A FROM A POLYOXAZOLIDINE PREPOLYMER AND POLYISOCYANATE HITACHI, LTD. (JA) 1976-09-07 US disclosed
US-3963679-A KNEADING BAYER AKTIENGESELLSCHAFT (DT) 1976-06-15 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-20220175632-A1 OIL-IN-WATER EMULSION COSMETIC CUTA, CENPE, SMURF1 ALDH1A1 3889/4885CYP3A4 4639/4885HPGD 2182/4885
US-20220160615-A1 COSMETIC, COSMETIC FOR USE IN WARMED STATE, AND BEAUTY METHOD LRBA, CUTA, GLMN ALDH1A1 3077/4885CYP3A4 4358/4885HPGD 2929/4885

“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.