SCHEMBL4091970

SCHEMBL4091970

CCCCC(CC)NNC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.45
MAPK1 P28482 1/20 0.45
CA1 P00915 4/20 0.41
PLA2G2C Q5R387 2/20 0.41
GPR84 Q9NQS5 3/20 0.35
FFAR1 O14842 1/20 0.35
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
LCK P06239 1/20 0.34
PPARD Q03181 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34

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
SCHEMBL28032610 0.94 GPR84 (0.42) CA2MAPK1CA1PLA2G2CGPR84
SCHEMBL27829026 0.88 PLA2G2C (0.45) CA2MAPK1CA1PLA2G2CGPR84
SCHEMBL28196501 0.88 TAS1R3 (0.40) CA2MAPK1CA1
SCHEMBL28251103 0.84 GPR84 (0.48) CA2PLA2G2CGPR84FFAR1MAPT
SCHEMBL13902710 0.82 CA2 (0.40) CA2MAPK1CA1PLA2G2CALDH1A1
SCHEMBL28223515 0.80 MAPT (0.35) PLA2G2CALDH1A1MAPT
SCHEMBL1388452 0.79 CA2 (0.48) CA2MAPK1CA1PLA2G2CGPR84
Hydrochloric Acid SCHEMBL10822847 0.78 CA2 (0.47) CA2MAPK1CA1PLA2G2C
SCHEMBL28849586 0.78 TAS1R3 (0.44) CA2MAPK1CA1GPR84
SCHEMBL28154509 0.77 LMNA (0.44) CA2CA1ALDH1A1

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
CN-108137616-A Antibacterial agents comprising pyrazino [2,3-b ] [1,4] oxazin-3-ones or related ring systems 葛兰素史克知识产权开发有限公司 2018-06-08 CN disclosed
CN-101454313-A P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC (US) 2009-06-10 CN disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
CN-100384843-C CGRP receptor antagonists MERCK & CO INC (US) 2008-04-30 CN disclosed
EP-1183229-B1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK AS (DK) 2005-10-26 EP disclosed
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 US disclosed
US-6875760-B2 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2005-04-05 US disclosed
US-20030220350-A1 Glucagon antagonists/inverse agonists PFIZER INC 2003-11-27 US disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 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 (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-20050203108-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR CA2 3233/4885MAPK1 380/4885CA1 4464/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR CA2 3233/4885MAPK1 380/4885CA1 4464/4885
US-20030220350-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR CA2 3233/4885MAPK1 380/4885CA1 4464/4885

“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.