SCHEMBL3963570

SCHEMBL3963570

CCO[C@H](C(=O)O)C(CC)c1ccc(OCC(=O)N(CC)Cc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 12/20 0.52
FFAR1 O14842 2/20 0.48
PPARG P37231 1/20 0.48
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PSMB5 P28074 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL3963786 0.96 FFAR1 (0.49) TRPM8FFAR1PPARGMEN1KMT2A
SCHEMBL3964677 0.91 TRPM8 (0.49) TRPM8MEN1KMT2ANPC1RAB9A
SCHEMBL3964005 0.91 FFAR1 (0.45) TRPM8FFAR1PPARGMEN1KMT2A
SCHEMBL3959697 0.91 TRPM8 (0.48) TRPM8PPARGNPC1RAB9A
SCHEMBL3963025 0.88 TRPM8 (0.63) TRPM8NPC1RAB9A
SCHEMBL3963639 0.87 TRPM8 (0.51) TRPM8FFAR1NPC1RAB9A
SCHEMBL3960806 0.83 MEN1 (0.46) TRPM8FFAR1MEN1KMT2ARAB9A
SCHEMBL3961372 0.83 FFAR1 (0.47) TRPM8FFAR1
SCHEMBL3963601 0.82 TRPM8 (0.56) TRPM8PPARG
SCHEMBL4901333 0.82 TRPM8 (0.56) TRPM8PPARG

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
US-7488844-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-02-10 US disclosed
US-7462644-B2 Therapeutic agents ASTRAZENECA AB (SE) 2008-12-09 US disclosed
US-20050282822-A1 Therapeutic agents ASTRAZENECA AB (SE) 2005-12-22 US disclosed
US-20050131068-A1 Therapeutic agents ASTRAZENECA AB (SE) 2005-06-16 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-20050131068-A1 Therapeutic agents GPR119, INSR, LIPA TRPM8 4238/4885FFAR1 30/4885PPARG 479/4885
US-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP TRPM8 4071/4885FFAR1 106/4885PPARG 228/4885

“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.