SCHEMBL427369

SCHEMBL427369

CN(C(=O)n1cnc(-c2ccc(F)c(F)c2)c1)C1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.49
CES2 O00748 1/20 0.49
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
GRIN2B Q13224 8/20 0.39
PIK3CD O00329 1/20 0.38
KAT6A Q92794 2/20 0.38
KAT5 Q92993 2/20 0.38
KAT8 Q9H7Z6 2/20 0.38
PDE4B Q07343 1/20 0.37
TGFBR1 P36897 1/20 0.37
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37
MAPK1 P28482 2/20 0.35
KMO O15229 1/20 0.35

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
SCHEMBL427883 0.92 FAAH (0.48) FAAHCES2KDM4EPOLBPIK3CD
SCHEMBL424911 0.92 FAAH (0.48) FAAHCES2KDM4EPOLBGRIN2B
SCHEMBL427361 0.90 FAAH (0.52) FAAHCES2KDM4EGRIN2BPDE4B
SCHEMBL427101 0.89 FAAH (0.61) FAAHCES2POLBGRIN2BKMO
SCHEMBL427411 0.89 FAAH (0.48) FAAHCES2PIK3CDPDE4B
SCHEMBL427345 0.89 FAAH (0.46) FAAHCES2KDM4EGRIN2BKAT6A
SCHEMBL427871 0.88 FAAH (0.52) FAAHCES2PDE4BTGFBR1
SCHEMBL14950261 0.86 FAAH (0.53) FAAHCES2KDM4EPOLBGRIN2B
SCHEMBL427732 0.86 FAAH (0.53) FAAHCES2TGFBR1MTOR
SCHEMBL427868 0.85 FAAH (0.59) FAAHCES2POLBPDE4BTGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2606035-B1 PROCES FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS BIAL - PORTELA & CA S A (PT) 2017-09-06 EP disclosed
US-9458111-B2 Process for the synthesis of substituted urea compounds BIAL—PORTELA & CA, S.A. (PT) 2016-10-04 US disclosed
US-9458111-B2 Process for the synthesis of substituted urea compounds BIAL—PORTELA & CA, S.A. (PT) 2016-10-04 US disclosed
US-9458111-B2 Process for the synthesis of substituted urea compounds BIAL—PORTELA & CA, S.A. (PT) 2016-10-04 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-20130123493-A1 PROCESS FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS BIAL - PORTELA & CA, S.A. (PT) 2013-05-16 US disclosed
US-20130123493-A1 PROCESS FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS BIAL - PORTELA & CA, S.A. (PT) 2013-05-16 US disclosed
US-20130123493-A1 PROCESS FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS BIAL - PORTELA & CA, S.A. (PT) 2013-05-16 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 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-20130123493-A1 PROCESS FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS UTS2R, ARG1, PRMT1 FAAH 2166/4885CES2 463/4885KDM4E 667/4885
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS FAAH, FAAH2, ASAH1 FAAH 1/4885CES2 62/4885KDM4E 1982/4885

“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.