SCHEMBL22074382

SCHEMBL22074382

O=C(COc1ccc2c(c1)OCO2)N(CC1CCCO1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 2/20 0.63
▸ HPGD P15428 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ TSHR P16473 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ TP53 P04637 2/20 0.46
▸ HSD17B10 Q99714 1/20 0.44
▸ FKBP1A P62942 1/20 0.44
▸ RAB9A P51151 6/20 0.44
▸ NPC1 O15118 5/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ PKM P14618 1/20 0.43
▸ POLB P06746 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
SCHEMBL20773407 0.87 TRPM8 (0.52) TRPM8HPGDALDH1A1NPSR1TSHR
SCHEMBL22074383 0.86 TRPM8 (0.50) TRPM8HPGDALDH1A1NPSR1TSHR
SCHEMBL20773840 0.83 TP53 (0.52) HPGDALDH1A1NPSR1TP53HSD17B10
SCHEMBL22074361 0.83 ALDH1A1 (0.59) TRPM8HPGDALDH1A1NPSR1TSHR
SCHEMBL20777304 0.83 KMT2A (0.52) HPGDALDH1A1NPSR1TSHRL3MBTL1
SCHEMBL20772763 0.83 TRPM8 (0.54) TRPM8HPGDALDH1A1NPSR1TP53
SCHEMBL20777355 0.82 POLB (0.52) HPGDALDH1A1NPSR1TP53RAB9A
SCHEMBL22109121 0.81 TRPM8 (0.61) TRPM8HPGDALDH1A1TSHRHSD17B10
SCHEMBL20777372 0.77 GAA (0.54) ALDH1A1TP53RAB9AMAPTPOLB
SCHEMBL10270943 0.77 TRPM8 (1.00) TRPM8ALDH1A1L3MBTL1FKBP1ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3675809-B1 USE OF PHYSIOLOGICAL COOLING INGREDIENTS AND AGENTS CONTAINING SUCH ACTIVE INGREDIENTS BASF SE (DE) 2023-09-27 — — EP disclosed
EP-3675809-B1 USE OF PHYSIOLOGICAL COOLING INGREDIENTS AND AGENTS CONTAINING SUCH ACTIVE INGREDIENTS BASF SE (DE) 2023-09-27 — — EP disclosed
US-11434220-B2 Use of physiological cooling active ingredients, and compositions comprising such active ingredients BASF SE (DE) 2022-09-06 — — US disclosed
US-20200190052-A1 USE OF PHYSIOLOGICAL COOLING ACTIVE INGREDIENTS, AND COMPOSITIONS COMPRISING SUCH ACTIVE INGREDIENTS BASF SE (DE) 2020-06-18 — — US disclosed
US-20200190052-A1 USE OF PHYSIOLOGICAL COOLING ACTIVE INGREDIENTS, AND COMPOSITIONS COMPRISING SUCH ACTIVE INGREDIENTS BASF SE (DE) 2020-06-18 — — 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 (2 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 1/4885HPGD 1710/4885ALDH1A1 1810/4885
US-20200190052-A1 USE OF PHYSIOLOGICAL COOLING ACTIVE INGREDIENTS, AND COMPOSITIONS COMPRISING SUCH ACTIVE INGREDIENTS TRPM8, TRPM7, TRPM5 TRPM8 1/4885HPGD 1710/4885ALDH1A1 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.

Send feedback