SCHEMBL29779963

SCHEMBL29779963

O=C(C=Cc1ccc2c(c1)OCO2)N(c1ccccn1)C1CCSC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 14/20 0.76
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 3/20 0.53
POLB P06746 1/20 0.53
LMNA P02545 3/20 0.53
MAPT P10636 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
MEN1 O00255 1/20 0.53
PLIN1 O60240 1/20 0.53
PKM P14618 1/20 0.53
MAPK1 P28482 1/20 0.53
PLIN5 Q00G26 1/20 0.53
KMT2A Q03164 1/20 0.53
ABHD5 Q8WTS1 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
HTT P42858 1/20 0.51
CACNA1B Q00975 1/20 0.48
APBA1 Q02410 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL20772855 1.00 TRPM8 (0.76) TRPM8KDM4EALDH1A1POLBLMNA
SCHEMBL1699240 0.87 TRPM8 (1.00) TRPM8KDM4EALDH1A1POLBLMNA
SCHEMBL30416175 0.87 TRPM8 (1.00) TRPM8KDM4EALDH1A1POLBLMNA
SCHEMBL14822024 0.87 TRPM8 (1.00) TRPM8KDM4EALDH1A1POLBLMNA
SCHEMBL30532217 0.87 TRPM8 (1.00) TRPM8KDM4EALDH1A1POLBLMNA
SCHEMBL1699243 0.87 TRPM8 (1.00) TRPM8KDM4EALDH1A1POLBLMNA
SCHEMBL22074404 0.85 TRPM8 (0.74) TRPM8NPC1RAB9ASMN1; SMN2
SCHEMBL20773411 0.85 TRPM8 (0.55) TRPM8KDM4EALDH1A1LMNAMAPT
SCHEMBL20777268 0.84 TRPM8 (0.71) TRPM8KDM4EALDH1A1POLBLMNA
SCHEMBL29779992 0.84 TRPM8 (0.71) TRPM8KDM4EALDH1A1POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11434220-B2 Use of physiological cooling active ingredients, and compositions comprising such active ingredients BASF SE (DE) 2022-09-06 US claimed
EP-3675809-B1 USE OF PHYSIOLOGICAL COOLING INGREDIENTS AND AGENTS CONTAINING SUCH ACTIVE INGREDIENTS BASF SE (DE) 2023-09-27 EP 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-11434220-B2 Use of physiological cooling active ingredients, and compositions comprising such active ingredients TRPM8, TRPM7, TRPM5 TRPM8 1/4885KDM4E 3711/4885ALDH1A1 1810/4885

“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.