SCHEMBL13638227

SCHEMBL13638227

CCCCOC(=O)N(CCC(C)C)Cc1ccc(-c2ccc(C(=O)/N=C/N(C)C)cc2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.40
LPAR1 Q92633 2/20 0.37
LPAR5 Q9H1C0 2/20 0.37
FSHR P23945 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.34
CTSD P07339 1/20 0.33
OXTR P30559 1/20 0.33
AVPR1A P37288 1/20 0.33

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
SCHEMBL4480569 0.86 LPAR1 (0.37) RARBLPAR1LPAR5OXTRAVPR1A
SCHEMBL4480567 0.86 LPAR1 (0.37) RARBLPAR1LPAR5OXTRAVPR1A
SCHEMBL13638168 0.85 RARB (0.44) RARBLPAR1LPAR5FSHRLTB4R2
SCHEMBL13638254 0.83 FAAH (0.36) RARBLPAR1LPAR5
SCHEMBL13638171 0.80 RARB (0.39) RARBLPAR1LPAR5FSHRLTB4R2
SCHEMBL13638404 0.77 MAPT (0.38) RARBFSHR
SCHEMBL4072874 0.70 LPAR1 (0.41) RARBLPAR1LPAR5OXTRAVPR1A
SCHEMBL14217477 0.69 AKR1C3 (0.42) RARBLPAR1LPAR5
SCHEMBL13633129 0.68 LPAR1 (0.34) LPAR1LPAR5
SCHEMBL13638253 0.67 FAAH (0.39) RARBLPAR1LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615651-B2 Diaryl, dipyridinyl and aryl-pyridinyl derivatives and uses thereof PFIZER INC. (US) 2009-11-10 US disclosed
US-20080167371-A1 Diaryl, Dipyridinyl and Aryl-Pyridinyl Derivatives and Uses Thereof PFIZER INC. 2008-07-10 US disclosed
WO-2008059335-A1 DIARYL, DIPYRIDINYL AND ARYL-PYRIDINYL DERIVATIVES AND USES THEREOF PFIZER PRODUCTS INC. (US) 2008-05-22 WO 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-20080167371-A1 Diaryl, Dipyridinyl and Aryl-Pyridinyl Derivatives and Uses Thereof OPRD1, OPRK1, OPRL1 RARB 264/4885LPAR1 1517/4885LPAR5 1925/4885

“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.