SCHEMBL17274359

SCHEMBL17274359

Brc1ccc(C(OC2CN(C(c3ccccc3)c3ccccc3)C2)c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.66
OPRM1 P35372 4/20 0.46
OPRD1 P41143 3/20 0.46
OPRK1 P41145 3/20 0.46
OPRL1 P41146 2/20 0.46
DRD3 P35462 3/20 0.45
CHRM2 P08172 2/20 0.45
ADRA2A P08913 2/20 0.45
CHRM1 P11229 2/20 0.45
DRD1 P21728 2/20 0.45
SLC6A2 P23975 2/20 0.45
ADRA1A P35348 2/20 0.45
SLC6A3 Q01959 2/20 0.45
KCNH2 Q12809 2/20 0.45
CYP2D6 P10635 2/20 0.45
HTR1A P08908 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
IGF1R P08069 1/20 0.45

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
SCHEMBL4078340 1.00 NAAA (0.66) NAAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL11402799 0.91 DRD3 (0.53) NAAAOPRM1OPRD1OPRK1DRD3
SCHEMBL4077695 0.85 MEN1 (0.58) DRD3CHRM2ADRA2ACHRM1DRD1
SCHEMBL9596982 0.80 OPRM1 (0.44) NAAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL17274421 0.79 NAAA (1.00) NAAAOPRM1OPRD1OPRK1DRD3
SCHEMBL24238319 0.78 OPRM1 (0.54) NAAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL24238338 0.78 OPRM1 (0.54) NAAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL24238344 0.77 OPRM1 (0.42) NAAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL24238281 0.77 OPRM1 (0.42) NAAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL17279134 0.76 NAAA (0.58) NAAAOPRM1OPRD1OPRK1DRD3

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
US-10640494-B2 N-acylethanolamine hydrolyzing acid amidase (NAAA) inhibitors and their use thereof NORTHEASTERN UNIVERSITY (US) 2020-05-05 US disclosed
US-20180222894-A1 N-Acylethanolamine Hydrolyzing Acid Amidase (NAAA) Inhibitors And Their Use Thereof NORTHEASTERN UNIVERSITY 2018-08-09 US disclosed
US-20180222894-A1 N-Acylethanolamine Hydrolyzing Acid Amidase (NAAA) Inhibitors And Their Use Thereof NORTHEASTERN UNIVERSITY 2018-08-09 US disclosed
US-9963444-B2 N-acylethanolamine hydrolyzing acid amidase (NAAA) inhibitors and their use thereof NORTHEASTERN UNIVERSITY (US) 2018-05-08 US disclosed
US-9963444-B2 N-acylethanolamine hydrolyzing acid amidase (NAAA) inhibitors and their use thereof NORTHEASTERN UNIVERSITY (US) 2018-05-08 US disclosed
US-20170114050-A1 N-Acylethanolamine Hydrolyzing Acid Amidase (NAAA) Inhibitors And Their Use Thereof NORTHEASTERN UNIVERSITY 2017-04-27 US disclosed
US-20170114050-A1 N-Acylethanolamine Hydrolyzing Acid Amidase (NAAA) Inhibitors And Their Use Thereof NORTHEASTERN UNIVERSITY 2017-04-27 US disclosed
US-20170114050-A1 N-Acylethanolamine Hydrolyzing Acid Amidase (NAAA) Inhibitors And Their Use Thereof NORTHEASTERN UNIVERSITY 2017-04-27 US disclosed
EP-3145505-A1 N-ACYLETHANOLAMINE HYDROLYZING ACID AMIDASE (NAAA) INHIBITORS AND THEIR USE THEREOF Northeastern University (US) 2017-03-29 EP disclosed
WO-2015179190-A1 N-ACYLETHANOLAMINE HYDROLYZING ACID AMIDASE (NAAA) INHIBITORS AND THEIR USE THEREOF NORTHEASTERN UNIVERSITY (US) 2015-11-26 WO disclosed
WO-2015179190-A1 N-ACYLETHANOLAMINE HYDROLYZING ACID AMIDASE (NAAA) INHIBITORS AND THEIR USE THEREOF NORTHEASTERN UNIVERSITY (US) 2015-11-26 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 (3 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-20180222894-A1 N-Acylethanolamine Hydrolyzing Acid Amidase (NAAA) Inhibitors And Their Use Thereof NAAA, NAT1, NAALAD2 NAAA 1/4885OPRM1 1995/4885OPRD1 3874/4885
US-10640494-B2 N-acylethanolamine hydrolyzing acid amidase (NAAA) inhibitors and their use thereof NAAA, NAT1, NAALAD2 NAAA 1/4885OPRM1 1995/4885OPRD1 3874/4885
US-20170114050-A1 N-Acylethanolamine Hydrolyzing Acid Amidase (NAAA) Inhibitors And Their Use Thereof NAAA, NAT1, NIT2 NAAA 1/4885OPRM1 2241/4885OPRD1 4223/4885

“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.