SCHEMBL427732

SCHEMBL427732

CN(C(=O)n1cnc(-c2ccc(O)cc2)c1)C1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.53
CES2 O00748 1/20 0.53
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
TGFBR1 P36897 1/20 0.39
MTOR P42345 2/20 0.38
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
FYN P06241 3/20 0.36
HSD11B1 P28845 1/20 0.36
CSF1R P07333 1/20 0.36
HTR6 P50406 1/20 0.35
MCHR1 Q99705 5/20 0.35
CYP2D6 P10635 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
SCHEMBL14950261 0.91 FAAH (0.53) FAAHCES2TGFBR1NPC1RAB9A
SCHEMBL427361 0.89 FAAH (0.52) FAAHCES2TGFBR1
SCHEMBL427871 0.89 FAAH (0.52) FAAHCES2TGFBR1NPC1RAB9A
SCHEMBL427868 0.89 FAAH (0.59) FAAHCES2TGFBR1NPC1RAB9A
SCHEMBL427874 0.89 FAAH (0.64) FAAHCES2MKNK1MKNK2NPC1
SCHEMBL426220 0.88 FAAH (0.53) FAAHCES2MKNK1TGFBR1FYN
SCHEMBL425914 0.88 FAAH (0.66) FAAHCES2NPC1RAB9AFYN
SCHEMBL426156 0.87 FAAH (0.50) FAAHCES2NPC1RAB9AHTR6
SCHEMBL7899710 0.87 FAAH (0.48) FAAHCES2TGFBR1MTORHSD11B1
SCHEMBL424911 0.87 FAAH (0.48) FAAHCES2TGFBR1MTORMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
WO-2010074588-A2 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2010-07-01 WO 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-20120065191-A1 PHARMACEUTICAL COMPOUNDS FAAH, FAAH2, ASAH1 FAAH 1/4885CES2 62/4885MKNK1 4078/4885

“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.