SCHEMBL29524575

SCHEMBL29524575

CCCCCCC(CCCCCCCCCCC(=O)O)N(C)c1ccc([N+](=O)[O-])c2nonc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ GSTP1 P09211 12/20 0.42
▸ GSTM2 P28161 11/20 0.42
▸ CNR2 P34972 1/20 0.40
▸ MYC P01106 2/20 0.39
▸ MAX P61244 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ S100A4 P26447 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL6259333 0.80 MEN1 (0.54) MEN1KMT2AGSTP1GSTM2
SCHEMBL7830878 0.77 GSTM2 (0.61) MEN1KMT2AGSTM2MYCMAX
SCHEMBL4439764 0.75 MEN1 (0.54) MEN1KMT2AGSTP1GSTM2USP2
SCHEMBL7714790 0.72 GSTP1 (0.54) MEN1KMT2AGSTP1GSTM2MYC
SCHEMBL3505281 0.70 MEN1 (0.59) MEN1KMT2AGSTP1GSTM2MYC
SCHEMBL15515612 0.69 GSTM2 (0.76) MEN1KMT2AGSTM2MYCMAX
SCHEMBL15516469 0.69 GSTM2 (0.76) MEN1KMT2AGSTM2MYCMAX
SCHEMBL1076589 0.68 MEN1 (0.60) MEN1KMT2AGSTP1GSTM2MYC
SCHEMBL6385100 0.68 GSTM2 (0.52) MEN1KMT2AGSTP1GSTM2MYC
Dodecanoate SCHEMBL27633294 0.68 PPARG (0.55) MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3452441-B1 ALPHA-TRUXILLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF UNIV NEW YORK STATE RES FOUND (US) 2025-08-27 — — EP disclosed
US-20240384208-A1 CLEANSING COMPOSITION CONOPCO, INC., D/B/A UNILEVER (US) 2024-11-21 — — US disclosed
EP-4408964-A1 CLEANSING COMPOSITION Unilever IP Holdings B.V. (NL) 2024-08-07 — — EP disclosed
CN-118076721-A Cleaning composition 联合利华知识产权控股有限公司 2024-05-24 — — CN disclosed
US-20240092725-A1 ALPHA-TRUXILLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2024-03-21 — — US disclosed
US-20230365488-A1 TRUXILLIC ACID MONOESTER-DERIVATIVES AS SELECTIVE FABP5 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS AND USES THEREOF THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-11-16 — — US disclosed
CN-117015371-A Sanitary cleaning composition for female private parts 联合利华知识产权控股有限公司 2023-11-07 — — CN disclosed
US-11739047-B2 Alpha-truxillic acid derivatives and pharmaceutical compositions thereof THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-08-29 — — US disclosed
CN-116615193-A Tumoxic acid monoester derivative as selective FABP5 inhibitor, pharmaceutical composition and application thereof 纽约州立大学研究基金会 2023-08-18 — — CN disclosed
EP-4225292-A1 TRUXILLIC ACID MONOESTER-DERIVATIVES AS SELECTIVE FABP5 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS AND USES THEREOF The Research Foundation for The State University of New York (US) 2023-08-16 — — EP disclosed
WO-2023052124-A1 CLEANSING COMPOSITION UNILEVER IP HOLDINGS B.V. (NL) 2023-04-06 — — WO disclosed
US-20230025694-A1 Silicone Hydrogel Based Fluorescent Assay and Contact Lens NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-01-26 — — US disclosed
US-11369295-B2 Silicone hydrogel based fluorescent assay and contact lens UNIVERSITY OF MARYLAND, BALTIMORE (US) 2022-06-28 — — US disclosed
CN-109415295-B Alpha-cocatalytic derivatives and pharmaceutical compositions thereof 纽约州立大学研究基金会 2022-05-17 — — CN disclosed
WO-2022076820-A1 TRUXILLIC ACID MONOESTER-DERIVATIVES AS SELECTIVE FABP5 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS AND USES THEREOF THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2022-04-14 — — WO 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 (5 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-20240092725-A1 ALPHA-TRUXILLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF FABP1, FABP2, FABP4 MEN1 4882/4885KMT2A 4597/4885GSTP1 2184/4885
US-20230025694-A1 Silicone Hydrogel Based Fluorescent Assay and Contact Lens CD44, CRYAA, IGFBP1 MEN1 901/4885KMT2A 4319/4885GSTP1 2365/4885
US-11739047-B2 Alpha-truxillic acid derivatives and pharmaceutical compositions thereof FABP1, FABP2, FABP4 MEN1 4880/4885KMT2A 4609/4885GSTP1 2197/4885
US-11369295-B2 Silicone hydrogel based fluorescent assay and contact lens CD44, CRYAA, IGFBP1 MEN1 901/4885KMT2A 4319/4885GSTP1 2365/4885
US-20230365488-A1 TRUXILLIC ACID MONOESTER-DERIVATIVES AS SELECTIVE FABP5 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS AND USES THEREOF FABP5, FABP1, FABP4 MEN1 4822/4885KMT2A 4141/4885GSTP1 2599/4885

“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.

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