SCHEMBL14809396

SCHEMBL14809396

Cc1cccc(C)c1N[C@@H](C)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2B P41595 1/20 0.45
PKM P14618 1/20 0.44
ATM Q13315 2/20 0.41
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 2/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GRIN3A Q8TCU5 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
KMT2A Q03164 2/20 0.40

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
SCHEMBL6264671 0.83 MAPK1 (0.47) DRD2HTR2AHTR2BPKMATM
SCHEMBL1677057 0.83 MAPK1 (0.47) DRD2HTR2AHTR2BPKMATM
SCHEMBL8039768 0.83 MAPK1 (0.47) DRD2HTR2AHTR2BPKMATM
SCHEMBL4411484 0.82 POLB (0.43) DRD2HTR2AHTR2BATMMAPK1
SCHEMBL6264012 0.82 POLB (0.43) DRD2HTR2AHTR2BATMMAPK1
SCHEMBL1900149 0.82 POLB (0.43) DRD2HTR2AHTR2BATMMAPK1
SCHEMBL11245214 0.82 ATM (0.42) DRD2HTR2AHTR2BATMMAPK1
SCHEMBL4411485 0.82 POLB (0.43) DRD2HTR2AHTR2BATMMAPK1
Hydrochloric Acid SCHEMBL14988824 0.81 POLB (0.42) PKMATMMAPK1ALDH1A1L3MBTL1
SCHEMBL5968639 0.79 POLB (0.50) PKMMAPK1ALDH1A1MEN1KMT2A

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
EP-2414543-B1 GENETIC MARKERS FOR RISK MANAGEMENT OF ATRIAL FIBRILLATION AND STROKE DECODE GENETICS EHF (IS) 2016-10-12 EP disclosed
US-20140221286-A1 SODIUM CHANNEL BLOCKERS REDUCE GLUCAGON SECRETION GILEAD SCIENCES, INC. 2014-08-07 US disclosed
US-8795963-B2 Genetic markers for risk management of atrial fibrillation and stroke DECODE GENETICS EHF. (IS) 2014-08-05 US disclosed
EP-2758053-A1 SODIUM CHANNEL BLOCKERS REDUCE GLUCAGON SECRETION Gilead Sciences, Inc. (US) 2014-07-30 EP disclosed
WO-2013043925-A1 SODIUM CHANNEL BLOCKERS REDUCE GLUCAGON SECRETION GILEAD SCIENCES, INC. (US) 2013-03-28 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-20140221286-A1 SODIUM CHANNEL BLOCKERS REDUCE GLUCAGON SECRETION IAPP, SCNN1B, GLP1R DRD2 2749/4885HTR2A 1150/4885HTR2B 866/4885

“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.