SCHEMBL3963642

SCHEMBL3963642

CCO[C@@](CC)(Cc1ccc(OCC(=O)N(CC)Cc2ccc(Cl)cc2)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 12/20 0.53
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 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
SCHEMBL3961377 0.96 TP53 (0.49) TRPM8TP53POLBMAPTCYP1A2
SCHEMBL3963030 0.92 TRPM8 (0.64) TRPM8NPC1RAB9A
SCHEMBL3960808 0.90 MEN1 (0.48) TRPM8TP53POLBMAPTRAB9A
SCHEMBL3956898 0.90 TP53 (0.52) TRPM8TP53POLBMAPTNPC1
SCHEMBL3965747 0.89 TRPM8 (0.48) TRPM8TP53POLBMAPTCYP1A2
SCHEMBL3964680 0.89 TRPM8 (0.52) TRPM8TP53MAPTNPC1RAB9A
SCHEMBL3959704 0.88 TRPM8 (0.51) TRPM8NPC1RAB9A
SCHEMBL3963575 0.88 TRPM8 (0.58) TRPM8NPC1RAB9A
SCHEMBL3963788 0.83 TRPM8 (0.52) TRPM8TP53MAPTRAB9A
SCHEMBL3961874 0.82 TP53 (0.50) TRPM8TP53MAPTNPC1RAB9A

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 4238/4885TP53 2284/4885POLB 3744/4885
US-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP TRPM8 4071/4885TP53 4725/4885POLB 4022/4885

“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.