SCHEMBL4484527

SCHEMBL4484527

Cn1c(C(=O)NC2CCC2)c2c(c(O)c1=O)C(=O)N(Cc1ccc(F)cc1)CC2

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 18/20 0.46
CNR1 P21554 17/20 0.46
FAAH O00519 7/20 0.44
ABHD12 Q8N2K0 3/20 0.42
ALOX5 P09917 1/20 0.42
EPHX2 P34913 1/20 0.42
ABHD6 Q9BV23 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
SCHEMBL4480856 0.96 CNR1 (0.44) CNR2CNR1FAAHABHD12ALOX5
SCHEMBL4486044 0.86 CNR1 (0.40) CNR2CNR1FAAH
SCHEMBL4486193 0.86 TP53 (0.45)
SCHEMBL4487792 0.85 THRB (0.46)
SCHEMBL13672778 0.83 AKR1B1 (0.43)
SCHEMBL4487954 0.83 ALOX5 (0.45) ALOX5EPHX2
SCHEMBL4481908 0.83 AKR1B1 (0.38) ALOX5EPHX2
SCHEMBL4489237 0.82 AKR1B1 (0.37)
SCHEMBL4475043 0.81 CNR2 (0.43) CNR2CNR1FAAHABHD12ALOX5
SCHEMBL4495602 0.81 AKR1B1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070179196-A1 Hiv integrase inhibitors MERCK SHARP & DOHME CORP. 2007-08-02 US claimed
EP-1725556-A1 HIV INTEGRASE INHIBITORS Merck & Co., Inc. (US) 2006-11-29 EP claimed
WO-2005087768-A1 HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2005-09-22 WO claimed
WO-2005087767-A1 HIV INTEGRASE INHIBITORS MERCK & CO., INC. (US) 2005-09-22 WO claimed
US-7598264-B2 HIV integrase inhibitors MERCK & CO., INC. (US) 2009-10-06 US disclosed
US-20070179196-A1 Hiv integrase inhibitors MERCK SHARP & DOHME CORP. 2007-08-02 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 (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-20070179196-A1 Hiv integrase inhibitors REV1, TYMP, POLR2H CNR2 4841/4885CNR1 4689/4885FAAH 3913/4885

“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.