SCHEMBL3959697

SCHEMBL3959697

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

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 12/20 0.48
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 2/20 0.39
EPHX2 P34913 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL3963570 0.91 TRPM8 (0.52) TRPM8NPC1RAB9APPARG
SCHEMBL3963025 0.88 TRPM8 (0.63) TRPM8NPC1RAB9AALDH1A1
SCHEMBL3964677 0.88 TRPM8 (0.49) TRPM8NPC1RAB9AEPHX2TP53
SCHEMBL3963639 0.87 TRPM8 (0.51) TRPM8NPC1RAB9AALDH1A1TP53
SCHEMBL3963786 0.87 FFAR1 (0.49) TRPM8RAB9AALDH1A1PPARGPPARA
SCHEMBL3961372 0.83 FFAR1 (0.47) TRPM8ALDH1A1TP53MAPTTHRB
SCHEMBL3970024 0.82 PPARA (0.55) TRPM8PPARGPPARA
SCHEMBL3964005 0.82 FFAR1 (0.45) TRPM8PPARGPPARA
SCHEMBL3956893 0.81 TP53 (0.50) TRPM8ALDH1A1TP53MAPTTHRB
SCHEMBL3961867 0.80 TRPM8 (0.47) TRPM8NPC1RAB9ATP53MAPT

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 4238/4885NPC1 15/4885RAB9A 1292/4885
US-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP TRPM8 4071/4885NPC1 14/4885RAB9A 1893/4885

“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.