SCHEMBL3711999

SCHEMBL3711999

Cc1ccc2nc(Cl)[nH]c2c1C

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.37
PDE3B Q13370 4/20 0.36
PDE3A Q14432 4/20 0.36
PDE2A O00408 1/20 0.36
P2RY12 Q9H244 1/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
MAPK1 P28482 1/20 0.35
HPGD P15428 2/20 0.31
GAA P10253 1/20 0.31
RECQL P46063 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TYMS P04818 1/20 0.31
NPC1 O15118 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL659974 0.84 MAPT (0.40) DAOALDH1A1MAPTTYMS
SCHEMBL353027 0.79 ALDH1A1 (0.41) DAOPDE3BPDE3APDE2AP2RY12
SCHEMBL7345392 0.78 PDE3B (0.42) PDE3BPDE3AALDH1A1KDM4EMAPT
SCHEMBL9144166 0.76 PDE3B (0.36) DAOPDE3BPDE3APDE2AP2RY12
SCHEMBL2541923 0.76 FABP6 (0.46) PDE3BPDE3APDE2AP2RY12ALDH1A1
SCHEMBL22349154 0.76 KDM4E (0.43) DAOPDE3BPDE3APDE2AP2RY12
SCHEMBL6139156 0.76 PARP1 (0.41) DAOPDE3BPDE3AALDH1A1HPGD
SCHEMBL5772321 0.76 MEN1 (0.39) DAOPDE3BPDE3APDE2AP2RY12
SCHEMBL4069922 0.76 SMN1; SMN2 (0.40) PDE3BPDE3APDE2AP2RY12ALDH1A1
SCHEMBL31024266 0.76 MEN1 (0.39) DAOPDE3BPDE3APDE2AP2RY12

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
US-20120165334-A1 Indole/Benzimidazole Compounds as mTOR Kinase Inhibitors AMGEN INC. (US) 2012-06-28 US disclosed
EP-2398791-A1 INDOLE/BENZIMIDAZOLE COMPOUNDS AS mTOR KINASE INHIBITORS Amgen, Inc (US) 2011-12-28 EP disclosed
WO-2010096314-A1 INDOLE/BENZIMIDAZOLE COMPOUNDS AS mTOR KINASE INHIBITORS AMGEN INC. (US) 2010-08-26 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 (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-20120165334-A1 Indole/Benzimidazole Compounds as mTOR Kinase Inhibitors MTOR, PIKFYVE, RICTOR DAO 3346/4885PDE3B 2410/4885PDE3A 2978/4885

“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.