SCHEMBL10113882

SCHEMBL10113882

CCC(C)c1ccc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 1.00
RXFP1 Q9HBX9 6/20 0.68
TP53 P04637 4/20 0.68
PORCN Q9H237 2/20 0.64
THRB P10828 1/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
MAPK1 P28482 1/20 0.61
CYP1A2 P05177 1/20 0.60
GAA P10253 1/20 0.58
ALOX15 P16050 1/20 0.57

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
SCHEMBL1064155 0.91 TRPA1 (1.00) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL3787737 0.86 TRPA1 (0.80) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL15394742 0.85 TRPA1 (0.78) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL10114054 0.85 RXFP1 (0.78) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL20079684 0.85 TRPA1 (0.78) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL10114021 0.84 TRPA1 (0.80) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL10130857 0.84 TRPA1 (0.77) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL3826453 0.84 TRPA1 (0.77) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL10113830 0.84 TRPA1 (0.77) TRPA1RXFP1TP53PORCNTHRB
SCHEMBL4533692 0.84 RXFP1 (0.78) TRPA1RXFP1TP53PORCNTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230372350-A1 ASTROCYTIC TRPA1 CHANNEL INHIBITION AS A NOVEL NEUROPROTECTIVE THERAPEUTIC TARGET IN THE PRODROMAL PHASES OF ALZHEIMER'S DISEASE UNIVERSITE GRENOBLE ALPES (FR) 2023-11-23 US claimed
CN-114903995-B Application of TRPA1 ion channel as drug target in amide herbicide poisoning 中国人民解放军军事科学院军事医学研究院 2023-07-28 CN claimed
EP-4213823-A1 ASTROCYTIC TRPA1 CHANNEL INHIBITION AS A NOVEL NEUROPROTECTIVE THERAPEUTIC TARGET IN THE PRODROMAL PHASES OF ALZHEIMER'S DISEASE Université Grenoble Alpes (FR) 2023-07-26 EP claimed
CN-116437920-A Astrocyte TRPA1 channel inhibition as a novel neuroprotective therapeutic target for the precursor phase of Alzheimer's disease 格勒诺布尔大学 2023-07-14 CN claimed
CN-114903995-A Application of TRPA1 ion channel as drug target in amide herbicide poisoning 中国人民解放军军事科学院军事医学研究院 2022-08-16 CN claimed
WO-2022058946-A1 ASTROCYTIC TRPA1 CHANNEL INHIBITION AS A NOVEL NEUROPROTECTIVE THERAPEUTIC TARGET IN THE PRODROMAL PHASES OF ALZHEIMER'S DISEASE UNIVERSITÉ GRENOBLE ALPES (FR) 2022-03-24 WO claimed
US-20250241356-A1 ORAL COMPOSITION COMPRISING RECEPTOR MODULATOR DANIEL MICHAEL S (US) 2025-07-31 US disclosed
US-20250064846-A1 TREATMENT AND PREVENTION OF TRIGEMINAL NEURALGIA THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2025-02-27 US disclosed
US-20240285623-A1 TRPA1 CHANNEL ANTAGONIST COMPOUND FOR USE IN DEGENERATIVE RETINAL DISEASES FLONEXT S.R.L. (IT) 2024-08-29 US disclosed
EP-4351540-A1 TRPA1 CHANNEL ANTAGONIST COMPOUND FOR USE IN DEGENERATIVE RETINAL DISEASES Flonext S.r.l. (IT) 2024-04-17 EP disclosed
CN-117460501-A TRPA1 channel antagonist compounds for degenerative retinal diseases 弗洛内克斯特(股份)责任有限公司 2024-01-26 CN disclosed
CN-117180431-A Application of TRPA1 ion channel as drug target in amide herbicide poisoning 中国人民解放军军事科学院军事医学研究院 2023-12-08 CN disclosed
US-20230372350-A1 ASTROCYTIC TRPA1 CHANNEL INHIBITION AS A NOVEL NEUROPROTECTIVE THERAPEUTIC TARGET IN THE PRODROMAL PHASES OF ALZHEIMER'S DISEASE UNIVERSITE GRENOBLE ALPES (FR) 2023-11-23 US disclosed
US-20110151018-A1 METHODS OF INSECT CONTROL BRANDEIS UNIVERSITY (US) 2011-06-23 US disclosed
US-20100267750-A1 METHODS AND COMPOSITIONS FOR TREATING PAIN ELI LILLY AND COMPANY 2010-10-21 US disclosed
US-20100267750-A1 METHODS AND COMPOSITIONS FOR TREATING PAIN ELI LILLY AND COMPANY 2010-10-21 US disclosed
US-7671061-B2 Inhibit Transient Receptor Potential A1 (TRPA1) activity ; incontinence HYDRA BIOSCIENCES, INC. (US) 2010-03-02 US disclosed
US-7671061-B2 Inhibit Transient Receptor Potential A1 (TRPA1) activity ; incontinence HYDRA BIOSCIENCES, INC. (US) 2010-03-02 US disclosed
US-20070219222-A1 Inhibit Transient Receptor Potential A1 (TRPA1) activity ; incontinence HYDRA BIOSCIENCES (US) 2007-09-20 US disclosed
US-20070219222-A1 Inhibit Transient Receptor Potential A1 (TRPA1) activity ; incontinence HYDRA BIOSCIENCES (US) 2007-09-20 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 (6 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-20110151018-A1 METHODS OF INSECT CONTROL TRPA1, TRPV1, TRPV2 TRPA1 1/4885RXFP1 2802/4885TP53 4822/4885
US-20230372350-A1 ASTROCYTIC TRPA1 CHANNEL INHIBITION AS A NOVEL NEUROPROTECTIVE THERAPEUTIC TARGET IN THE PRODROMAL PHASES OF ALZHEIMER'S DISEASE TRPA1, APP, TRPV2 TRPA1 1/4885RXFP1 789/4885TP53 1974/4885
US-20250064846-A1 TREATMENT AND PREVENTION OF TRIGEMINAL NEURALGIA TRPA1, TRPV1, TRPV3 TRPA1 1/4885RXFP1 1225/4885TP53 4757/4885
US-20100267750-A1 METHODS AND COMPOSITIONS FOR TREATING PAIN ACHE, COL2A1, MMP8 TRPA1 59/4885RXFP1 611/4885TP53 4400/4885
US-20070219222-A1 Inhibit Transient Receptor Potential A1 (TRPA1) activity ; incontinence TRPA1, TRPV1, TRPV2 TRPA1 1/4885RXFP1 33/4885TP53 4573/4885
US-20240285623-A1 TRPA1 CHANNEL ANTAGONIST COMPOUND FOR USE IN DEGENERATIVE RETINAL DISEASES TRPA1, TRPM2, TRPV1 TRPA1 1/4885RXFP1 353/4885TP53 4042/4885

“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.