SCHEMBL3970097

SCHEMBL3970097

Cc1ccc(NC(=O)O)c(-c2cccc(Cl)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CHRM3 P20309 9/20 0.47
DHODH Q02127 2/20 0.47
CHRM1 P11229 4/20 0.46
CHRM2 P08172 2/20 0.44
FABP4 P15090 2/20 0.43
FABP3 P05413 1/20 0.43
ADORA1 P30542 1/20 0.43
S1PR4 O95977 1/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 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
Trifluoroacetic Acid SCHEMBL5106872 0.92 MEN1 (0.44) MEN1ALDH1A1KMT2AL3MBTL1CHRM3
SCHEMBL16438643 0.89 FABP4 (0.52) CHRM3DHODHCHRM1CHRM2FABP4
SCHEMBL3910746 0.85 AKR1C4 (0.47) MEN1ALDH1A1KMT2AL3MBTL1CHRM3
SCHEMBL5100217 0.84 HDAC7 (0.57) MEN1ALDH1A1KMT2AL3MBTL1CHRM3
SCHEMBL5100285 0.84 CHRM3 (0.56) MEN1KMT2ACHRM3CHRM1CHRM2
SCHEMBL16438568 0.83 KMT2A (0.53) MEN1ALDH1A1KMT2AL3MBTL1CHRM3
SCHEMBL3913042 0.83 CHRM1 (0.56) MEN1ALDH1A1KMT2AL3MBTL1CHRM3
SCHEMBL16438547 0.82 CHRM3 (0.56) CHRM3S1PR4
Hydrochloric Acid SCHEMBL5099086 0.82 CHRM1 (0.55) MEN1ALDH1A1KMT2AL3MBTL1CHRM3
Trifluoroacetic Acid SCHEMBL5107023 0.81 IDH2 (0.45) MEN1ALDH1A1KMT2AL3MBTL1DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1711183-A4 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LTD (GB) 2009-04-01 EP disclosed
US-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists LAINE DRAMANE I 2008-10-09 US disclosed
EP-1711183-A2 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2006-10-18 EP disclosed
WO-2005067537-A2 MUSCARINIC ACETYLCHOLINE RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2005-07-28 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 (1 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-20080249127-A1 Muscarinic Acetylcholine Receptor Antagonists CHRM3, CHRNG, CHRM2 MEN1 4053/4885ALDH1A1 2948/4885KMT2A 2510/4885

“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.