SCHEMBL530727

SCHEMBL530727

CN(C(=O)n1cnc(-c2cccc(C(=O)NOCc3ccccc3)c2)c1)C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.54
CES2 O00748 1/20 0.54
AXL P30530 1/20 0.42
MERTK Q12866 1/20 0.42
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
PTGER4 P35408 1/20 0.41
TRPV1 Q8NER1 2/20 0.41
TRPA1 O75762 1/20 0.41
MGLL Q99685 1/20 0.41
USP19 O94966 1/20 0.40
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
BACE1 P56817 1/20 0.38
TRPV3 Q8NET8 1/20 0.38
DAGLA Q9Y4D2 1/20 0.37

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
SCHEMBL14937811 0.92 FAAH (0.44) FAAHCES2AXLMERTKRAB9A
SCHEMBL14937999 0.91 FAAH (0.43) FAAHCES2AXLMERTKRAB9A
SCHEMBL14938000 0.91 FAAH (0.43) FAAHCES2AXLMERTKRAB9A
SCHEMBL425436 0.90 KDM1A (0.44) FAAHCES2KMT2A
SCHEMBL14937747 0.89 SLC5A7 (0.42) FAAHCES2AXLMERTKRAB9A
SCHEMBL526198 0.85 FAAH (0.58) FAAHCES2TRPV1TRPA1MGLL
SCHEMBL426103 0.83 FAAH (0.63) FAAHCES2RAB9ANPC1TRPV1
SCHEMBL14938277 0.83 KDM1A (0.49) FAAHCES2RAB9ANPC1
SCHEMBL424383 0.82 FAAH (0.74) FAAHCES2RAB9ANPC1TRPV1
SCHEMBL525315 0.82 FAAH (0.58) FAAHCES2TRPV1TRPA1MGLL

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 9 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
EP-2606035-A1 PROCES FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS BIAL - Portela & CA., S.A. (PT) 2013-06-26 EP 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
WO-2012015324-A1 PROCESS FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS BIAL - PORTELA & CA, S.A. (PT) 2012-02-02 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-20130123493-A1 PROCESS FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS UTS2R, ARG1, PRMT1 FAAH 2166/4885CES2 463/4885AXL 1486/4885

“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.