SCHEMBL17123795

SCHEMBL17123795

Fc1ccc(OC2CCC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 12/20 0.54
PARP10 Q53GL7 1/20 0.53
FURIN P09958 2/20 0.46
TRPA1 O75762 1/20 0.44
ADRB2 P07550 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
FAAH O00519 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL16242402 0.95 EPHX2 (0.58) EPHX2PARP10FURINTRPA1ADRB2
SCHEMBL9538528 0.93 EPHX2 (0.61) EPHX2PARP10TRPA1ADRB2FAAH
SCHEMBL9572112 0.91 EPHX2 (0.57) EPHX2PARP10ADRB2FAAH
SCHEMBL9572108 0.91 EPHX2 (0.57) EPHX2PARP10ADRB2FAAH
SCHEMBL30045 0.91 EPHX2 (0.57) EPHX2PARP10ADRB2FAAH
SCHEMBL5722140 0.87 EPHX2 (0.47) EPHX2PARP10TRPA1ADRB2FAAH
SCHEMBL19838848 0.83 HRH1 (0.58) EPHX2
SCHEMBL19921733 0.83 FURIN (0.49) EPHX2PARP10FURINTRPA1ADRB2
SCHEMBL1065750 0.81 EPHX2 (0.50) EPHX2PARP10ADRB2FAAH
SCHEMBL1065749 0.81 EPHX2 (0.50) EPHX2PARP10ADRB2FAAH

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-20150274736-A1 PDE9i with imidazo pyrazinone backbone SUNDIA MEDITECH COMPANY, LTD. (CN) 2015-10-01 US disclosed
US-20140088081-A1 Amino-Heterocyclic Compounds PFIZER INC. (US) 2014-03-27 US disclosed
US-20120329777-A1 Amino-Heterocyclic Compounds PFIZER INC. 2012-12-27 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 (3 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-20150274736-A1 PDE9i with imidazo pyrazinone backbone PDE9A, PDE5A, PDE12 EPHX2 1636/4885PARP10 1105/4885FURIN 1553/4885
US-20120329777-A1 Amino-Heterocyclic Compounds PDE9A, PDE2A, PDE10A EPHX2 1174/4885PARP10 1371/4885FURIN 458/4885
US-20140088081-A1 Amino-Heterocyclic Compounds PDE9A, PDE2A, PDE10A EPHX2 1174/4885PARP10 1371/4885FURIN 458/4885

“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.