SCHEMBL3772051

SCHEMBL3772051

O=C(O)c1cn(-c2ccc(OC(F)(F)F)cc2)cn1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 1/20 0.42
KDM4E B2RXH2 1/20 0.42
DHODH Q02127 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
SCHEMBL4435952 0.85 USP30 (0.46) KDM4E
SCHEMBL3770875 0.81 KDM4E (0.44) KDM4E
SCHEMBL4423070 0.81 CYP1A2 (0.50) KDM4E
SCHEMBL4428934 0.80 MEN1 (0.42) KDM4E
SCHEMBL9672218 0.79 KDM4E (0.47) KDM4E
SCHEMBL4425998 0.79 KMO (0.53)
SCHEMBL1261437 0.79 MAP4K4 (0.51) DHODH
SCHEMBL2174602 0.79 KDM4E (0.48) KDM4E
SCHEMBL27911750 0.77 KDM4E (0.47) KDM4E
SCHEMBL4422267 0.77 KDM4E (0.42) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101189228-A Bicyclic [3.1.0] heteroaryl amides as type I glycine transport inhibitors PFIZER PROD INC (US) 2008-05-28 CN claimed
EP-1869019-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS Pfizer Products Incorporated (US) 2007-12-26 EP claimed
WO-2006106425-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2006-10-12 WO claimed
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP disclosed
US-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors PFIZER INC. 2010-12-23 US disclosed
CN-101189228-A Bicyclic [3.1.0] heteroaryl amides as type I glycine transport inhibitors PFIZER PROD INC (US) 2008-05-28 CN 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 MARS1 1048/4885KDM4E 3142/4885DHODH 2249/4885
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors SLC1A2, SLC1A1, GLRA1 MARS1 1148/4885KDM4E 3324/4885DHODH 2310/4885

“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.