SCHEMBL5559520

SCHEMBL5559520

Cc1c([C@H](C)C(=O)NCO)c2c(F)c(O)ccc2n1C(=O)c1cccc(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 7/20 0.37
POLB P06746 1/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ELANE P08246 1/20 0.34
GPR139 Q6DWJ6 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP2B6 P20813 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL5559519 1.00 TRPV1 (0.37) TRPV1POLBCNR1CNR2ELANE
SCHEMBL5800355 0.93 PTGS2 (0.36) TRPV1POLBCNR1CNR2CYP2B6
SCHEMBL5559003 0.93 EGLN1 (0.37) TRPV1POLBCNR1CNR2GPR139
SCHEMBL5559007 0.93 EGLN1 (0.37) TRPV1POLBCNR1CNR2GPR139
SCHEMBL5559001 0.93 EGLN1 (0.37) TRPV1POLBCNR1CNR2GPR139
SCHEMBL5553952 0.91 KDM4E (0.37) ELANEGPR139MEN1KMT2A
SCHEMBL5553954 0.91 KDM4E (0.37) ELANEGPR139MEN1KMT2A
SCHEMBL5560440 0.90 POLB (0.37) TRPV1POLBCNR1CNR2
SCHEMBL5560445 0.90 POLB (0.37) TRPV1POLBCNR1CNR2
SCHEMBL5558899 0.90 CCKBR (0.38) TRPV1POLB

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-1643961-A4 COX-2 AND FAAH INHIBITORS MICROBIA INC (US) 2007-09-12 EP disclosed
EP-1643961-A2 COX-2 AND FAAH INHIBITORS Microbia, Inc. (US) 2006-04-12 EP disclosed
US-20050234244-A1 Synthesis of COX-2 and FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. 2005-10-20 US disclosed
US-20050032747-A1 COX-2 and FAAH inhibitors POLYMER CONCEPTS TECHNOLOGIES PBY, INC. 2005-02-10 US disclosed
WO-2005002525-A2 COX-2 AND FAAH INHIBITORS MICROBIA, INC. (US) 2005-01-13 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 (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-20050032747-A1 COX-2 and FAAH inhibitors FAAH2, FAAH, PTGS2 TRPV1 201/4885POLB 2692/4885CNR1 18/4885
US-20050234244-A1 Synthesis of COX-2 and FAAH inhibitors FAAH2, FAAH, PTGES2 TRPV1 1069/4885POLB 1611/4885CNR1 55/4885

“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.