Sugi Predict

Sugi Predict / Compounds / SCHEMBL2371651

SCHEMBL2371651

SCHEMBL2371651

Cc1cc([N+](=O)[O-])ccc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.64
▸ TDP1 Q9NUW8 5/20 0.64
▸ CYP3A4 P08684 3/20 0.64
▸ ALOX15 P16050 1/20 0.64
▸ TSHR P16473 4/20 0.60
▸ MAPT P10636 3/20 0.58
▸ TP53 P04637 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ NPY1R P25929 1/20 0.50
▸ NPY2R P49146 1/20 0.50
▸ SORT1 Q99523 1/20 0.50
▸ SRD5A2 P31213 1/20 0.50

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
SCHEMBL33664 1.00 ALDH1A1 (0.64) ALDH1A1TDP1CYP3A4ALOX15TSHR
Hydrochloric Acid SCHEMBL3133108 0.98 ALDH1A1 (0.62) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL31557927 0.91 ALDH1A1 (0.59) ALDH1A1TDP1CYP3A4ALOX15TSHR
Propylene Oxide SCHEMBL5231764 0.88 ALDH1A1 (0.51) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL27909691 0.87 ALDH1A1 (0.62) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL1761421 0.86 TDP1 (0.53) ALDH1A1TDP1CYP3A4ALOX15MAPT
SCHEMBL9098717 0.85 TSHR (0.60) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL30539159 0.85 ALDH1A1 (0.60) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL836536 0.85 ALDH1A1 (0.60) ALDH1A1TDP1CYP3A4ALOX15TSHR
SCHEMBL501960 0.85 ALDH1A1 (0.63) ALDH1A1TDP1CYP3A4ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119874502-A Method for producing 2-methyl-4-acetylbenzoic acid 帕潘纳(北京)科技有限公司 2025-04-25 — — CN claimed
EP-1141146-A1 POWDER-COATING COMPOSITIONS CONTAINING TRANSFER EFFICIENCY-ENHANCING ADDITIVES The Lubrizol Corporation (US) 2001-10-10 — — EP claimed
US-6201052-B1 FILM FORMING RESIN AND TRANSFERRING THE LUBRIZOL CORPORATION 2001-03-13 — — US claimed
WO-2000031192-A1 POWDER-COATING COMPOSITIONS CONTAINING TRANSFER EFFICIENCY-ENHANCING ADDITIVES THE LUBRIZOL CORPORATION (US) 2000-06-02 — — WO claimed
US-5973206-A Hydrogenation of aromatic nitrocompounds to aromatic amines VALTION TEKNILLINEN TUTKIMUSKESKUS (FI) 1999-10-26 — — US claimed
US-12595255-B2 Heteroaryl-substituted imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2026-04-07 — — US disclosed
US-12421211-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2025-09-23 — — US disclosed
CN-119954777-A 2, 4-Diaminopyrimidine compound and application thereof 沈阳药科大学 2025-05-09 — — CN disclosed
CN-119874502-A Method for producing 2-methyl-4-acetylbenzoic acid 帕潘纳(北京)科技有限公司 2025-04-25 — — CN disclosed
WO-2025072542-A1 COMPOSITIONS AND METHODS FOR DETERMINING PROTEIN INTERACTIONS THE UNIVERSITY OF CHICAGO (US) 2025-04-03 — — WO disclosed
US-12153051-B2 Reagents for quantitative mass spectrometry PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2024-11-26 — — US disclosed
US-20240368117-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-11-07 — — US disclosed
US-6201052-B1 FILM FORMING RESIN AND TRANSFERRING THE LUBRIZOL CORPORATION 2001-03-13 — — US disclosed
WO-2000031192-A1 POWDER-COATING COMPOSITIONS CONTAINING TRANSFER EFFICIENCY-ENHANCING ADDITIVES THE LUBRIZOL CORPORATION (US) 2000-06-02 — — WO disclosed
US-5973206-A Hydrogenation of aromatic nitrocompounds to aromatic amines VALTION TEKNILLINEN TUTKIMUSKESKUS (FI) 1999-10-26 — — US disclosed
EP-0923533-A1 HYDROGENATION OF AROMATIC NITROCOMPOUNDS TO AROMATIC AMINES VALTION TEKNILLINEN TUTKIMUSKESKUS (FI) 1999-06-23 — — EP disclosed
WO-1997030967-A1 HYDROGENATION OF AROMATIC NITROCOMPOUNDS TO AROMATIC AMINES VALTION TEKNILLINEN TUTKIMUSKESKUS (FI) 1997-08-28 — — WO disclosed
US-4499199-A COORDINATION POLYMERIZATION CATALYST CONSISTING OF ORGANOMAGNESIUM, TIN OR MERCAPTAN, AND TITANIUM TETRAHALIDE COMPOUND PHILLIPS PETROLEUM COMPANY (US) 1985-02-12 — — US disclosed
US-4322556-A Method for preparing aniline by reaction of nitrobenzene and vinylcyclohexene TEXACO INC. (US) 1982-03-30 — — US disclosed
US-3963698-A Alkylations employing in situ generation of diazoalkane alkylation reagents MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 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 (4 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-12153051-B2 Reagents for quantitative mass spectrometry CHAMP1, SRMS, QPCTL ALDH1A1 1505/4885TDP1 1723/4885CYP3A4 4775/4885
US-12421211-B2 Heterocyclic compounds F12, C1R, MRPL21 ALDH1A1 1889/4885TDP1 3036/4885CYP3A4 116/4885
US-20240368117-A1 HETEROCYCLIC COMPOUNDS F12, C1R, MRPL21 ALDH1A1 1889/4885TDP1 3036/4885CYP3A4 116/4885
US-12595255-B2 Heteroaryl-substituted imidazole derivatives CLIC1, CYP2B6, CYP2D6 ALDH1A1 367/4885TDP1 2173/4885CYP3A4 107/4885

“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.