SCHEMBL711161

SCHEMBL711161

CCN1CC2C(CNCC3CCCCC3)C2C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.36
ADH1B P00325 1/20 0.36
ADH1C P00326 1/20 0.36
ADH1A P07327 1/20 0.36
ADH4 P08319 1/20 0.36
ADH7 P40394 1/20 0.36
CXCR4 P61073 1/20 0.35
KDM4E B2RXH2 2/20 0.33
EPHX1 P07099 2/20 0.33
POLB P06746 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
SLC6A2 P23975 1/20 0.32

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
SCHEMBL711902 0.83 CHRM5 (0.42) ADH1BADH1CADH1AADH4ADH7
SCHEMBL708363 0.82 ADH1B (0.38) ADH1BADH1CADH1AADH4ADH7
SCHEMBL8043238 0.78 CXCR4 (0.49) HSD11B1ADH1BADH1CADH1AADH4
SCHEMBL711123 0.76 KDM4E (0.34) ADH1BADH1CADH1AADH4ADH7
SCHEMBL711160 0.74 EPHX1 (0.51) HSD11B1KDM4EEPHX1POLBCA12
SCHEMBL5507916 0.73 CXCR4 (0.46) CXCR4KDM4EPOLBL3MBTL1
SCHEMBL1679033 0.72 ADH1B (0.59) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1678544 0.72 ADH1B (0.59) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1679102 0.72 ADH1B (0.59) ADH1BADH1CADH1AADH4ADH7
SCHEMBL1678338 0.70 ADH1B (0.56) ADH1BADH1CADH1AADH4ADH7

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
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP claimed
US-8124639-B2 Bicyclic [3.1.0] heteroaryl amides as type 1 glycine transport inhibitors PFIZER INC. (US) 2012-02-28 US disclosed
US-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors PFIZER INC. 2010-12-23 US disclosed
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors PFIZER INC. 2006-10-12 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-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors SLC1A2, SLC1A1, SLC6A5 HSD11B1 1588/4885ADH1B 1148/4885ADH1C 752/4885
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors SLC1A2, SLC1A1, GLRA1 HSD11B1 1631/4885ADH1B 1074/4885ADH1C 704/4885

“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.