Sugi Predict

Sugi Predict / Compounds / SCHEMBL260384

SCHEMBL260384

SCHEMBL260384

Cc1ccc(-c2ccc(C=O)cc2)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 4/20 0.84
▸ ALDH1A1 P00352 5/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ PTK2B Q14289 1/20 0.47
▸ BRD4 O60885 1/20 0.47
▸ DRD1 P21728 1/20 0.47
▸ TYR P14679 1/20 0.46
▸ CYP2A13 Q16696 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ ALDH5A1 P51649 1/20 0.46
▸ ABAT P80404 1/20 0.46
▸ ALDH1A3 P47895 2/20 0.43

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
SCHEMBL13177700 1.00 CYP2A6 (0.84) CYP2A6ALDH1A1KDM4ENPC1RAB9A
Hydrogen Sulfide SCHEMBL28999805 0.97 CYP2A6 (0.80) CYP2A6ALDH1A1KDM4ENPC1RAB9A
SCHEMBL13707875 0.93 CYP2A6 (0.73) CYP2A6ALDH1A1KDM4ENPC1RAB9A
SCHEMBL29171 0.92 — —
P-Xylene SCHEMBL10939332 0.92 CYP2A6 (1.00) CYP2A6ALDH1A1KDM4ENPC1RAB9A
SCHEMBL8469408 0.92 CYP2A6 (1.00) CYP2A6ALDH1A1KDM4ENPC1RAB9A
SCHEMBL586152 0.89 CYP2A6 (0.94) CYP2A6ALDH1A1KDM4ENPC1RAB9A
SCHEMBL586330 0.89 CYP2A6 (0.94) CYP2A6ALDH1A1KDM4ENPC1RAB9A
Iodide SCHEMBL34461933 0.89 CYP2A6 (0.94) CYP2A6ALDH1A1KDM4ENPC1RAB9A
Hydrochloric Acid SCHEMBL14686576 0.89 CYP2A6 (0.94) CYP2A6ALDH1A1KDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5436374-A Process for producing 4-formyl-4'-methylbiphenyl from biphenyl MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-07-25 — — US claimed
JP-7041450-A — — None — — JP disclosed
WO-2024226603-A1 THERAPEUTIC COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2024-10-31 — — WO disclosed
CN-118666841-A Indole-tetramic acid compound, preparation and medical application thereof 中国医学科学院药物研究所 2024-09-20 — — CN disclosed
WO-2023039170-A1 SELECTIVE TARGETING OF CD38 ACTIVITY AS AN IMMUNOSTIMULATORY AND ANTITUMOR STRATEGY MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2023-03-16 — — WO disclosed
US-11485721-B2 Method for the metal-free preparation of a biaryl by a photosplicing reaction and their uses Leibniz-Institut für Naturstoff-Forschung und Infektionsbiologie e. V. Hans-Knöll-Institut (DE) 2022-11-01 — — US disclosed
EP-3307797-B1 ALIGNMENT POLYMERS TRANSITIONS OPTICAL INC (US) 2021-10-20 — — EP disclosed
US-20200361845-A1 Preparation and Use of Biphenyldicarboxylic Acids EXXONMOBIL CHEMICAL PATENTS INC. 2020-11-19 — — US disclosed
US-20200339529-A1 METHOD FOR THE METAL-FREE PREPARATION OF A BIARYL BY A PHOTOSPLICING REACTION AND THEIR USES LEIBNIZ-INSTITUT FÜR NATURSTOFF-FORSCHUNG UND INFEKTIONSBIOLOGIE E.V. HANS-KNÖLL-INSTITUT (HKI) (DE) 2020-10-29 — — US disclosed
CN-110317200-B Pyrimidinium compounds and uses thereof 东莞市东阳光农药研发有限公司 2020-09-11 — — CN disclosed
US-5366811-A Displaying IDEMITSU KOSAN CO., LTD. (JP) 1994-11-22 — — US disclosed
US-5324702-A Catalytic oxidation and oxidative dehydrogenation using metal-compound-loaded, deboronated hams-1b crystalline borosilicate molecular sieve compositions AMOCO CORPORATION (US) 1994-06-28 — — US disclosed
EP-0393668-B1 Method of preparation of benzaldehyde dialkyl acetals and new benzaldehyde dialkyl acetals BASF AG (DE) 1994-02-02 — — EP disclosed
US-5078838-A By electrochemical anodic oxidation of benzyl derivatives in the presence of an aliphatic alcohol BASF AKTIENGESELLSCHAFT (DE) 1992-01-07 — — US disclosed
EP-0393668-A2 Method of preparation of benzaldehyde dialkyl acetals and new benzaldehyde dialkyl acetals BASF Aktiengesellschaft (DE) 1990-10-24 — — EP disclosed
EP-0084147-A2 Phenyl hydrazones and their use BASF Aktiengesellschaft (DE) 1983-07-27 — — EP disclosed
US-4254035-A BY REACTING GLYCINE AND AN AROMATIC ALDEHYDE IN THE PRESENCE OF ACETIC ANHYDRIDE DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1981-03-03 — — US disclosed
US-3996210-A OPTICAL BRIGHTENERS SANDOZ LTD. (CH) 1976-12-07 — — US disclosed
US-3966678-A Maleic anhydride-polyaldimine prepolymers RHONE-POULENC S.A. (FR) 1976-06-29 — — US disclosed
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 — — 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 (3 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-11485721-B2 Method for the metal-free preparation of a biaryl by a photosplicing reaction and their uses CBR3, POR, CYP2F1 CYP2A6 17/4885ALDH1A1 809/4885KDM4E 3674/4885
US-20200339529-A1 METHOD FOR THE METAL-FREE PREPARATION OF A BIARYL BY A PHOTOSPLICING REACTION AND THEIR USES CBR3, POR, CYP2F1 CYP2A6 17/4885ALDH1A1 809/4885KDM4E 3674/4885
US-20200361845-A1 Preparation and Use of Biphenyldicarboxylic Acids BBOX1, DDT, DDC CYP2A6 110/4885ALDH1A1 1020/4885KDM4E 685/4885

“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.