SCHEMBL15928352

SCHEMBL15928352

Cc1nc(N)ccc1-c1cccc(C(N)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.47
DYRK1A Q13627 1/20 0.47
FYN P06241 2/20 0.46
BAZ2B Q9UIF8 1/20 0.46
BAZ2A Q9UIF9 1/20 0.46
PRKCI P41743 1/20 0.45
PRF1 P14222 1/20 0.44
MAP2K4 P45985 1/20 0.44
LRRK2 Q5S007 1/20 0.44
PDE2A O00408 2/20 0.44
PDE4D Q08499 2/20 0.44
PDE10A Q9Y233 2/20 0.44
PDE3A Q14432 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CCNT1 O60563 1/20 0.43
CCND1 P24385 1/20 0.43
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
CDK7 P50613 1/20 0.43

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
SCHEMBL4581864 0.78 RAB9A (0.51) DYRK1AFYNLRRK2NPC1RAB9A
SCHEMBL15730523 0.78 MKNK1 (0.70) PARP1DYRK1AFYNBAZ2BBAZ2A
SCHEMBL27668122 0.76 PARP1 (0.59) PARP1DYRK1AFYNBAZ2BBAZ2A
SCHEMBL10282887 0.75 FYN (0.51) PARP1DYRK1AFYNBAZ2BBAZ2A
SCHEMBL4581861 0.75 NOS3 (0.41) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL4504821 0.75 MTOR (0.57) NPC1RAB9A
SCHEMBL15928353 0.75 FYN (0.45) FYNPRKCIMAP2K4LRRK2CDK8
SCHEMBL15928351 0.75 CA1 (0.51) PRF1LRRK2BRD4
SCHEMBL15928349 0.74 ALOX5AP (0.43) MKNK1MKNK2GABRPGABRDGABRA1
SCHEMBL3701695 0.74 PARP1 (0.51) PARP1DYRK1AFYNBAZ2BBAZ2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2943481-B1 (HETERO)ARYLACETAMIDE DERIVATIVES AS ANTIRETROVIRAL AGENTS GILEAD SCIENCES INC (US) 2018-05-02 EP disclosed
US-9050344-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2015-06-09 US disclosed
US-20140221346-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-08-07 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 (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-20140221346-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, G6PD PARP1 2578/4885DYRK1A 4884/4885FYN 979/4885

“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.