SCHEMBL627296

SCHEMBL627296

CCN(C)c1nc(-n2cccn2)nc2cc(Cl)c(C(C)C)cc12

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 15/20 0.65
ADORA2A P29274 4/20 0.39
RORC P51449 1/20 0.32

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
SCHEMBL627538 0.91 EGLN1 (0.63) EGLN1ADORA2A
SCHEMBL627294 0.90 EGLN1 (0.61) EGLN1ADORA2A
SCHEMBL14991882 0.80 EGLN1 (0.51) EGLN1ADORA2ARORC
SCHEMBL14992354 0.80 EGLN1 (0.65) EGLN1ADORA2A
SCHEMBL10227669 0.79 EGLN1 (1.00) EGLN1
SCHEMBL14992287 0.78 EGLN1 (0.48) EGLN1ADORA2A
SCHEMBL14992348 0.76 ADORA2A (0.46) EGLN1ADORA2A
SCHEMBL627376 0.76 EGLN1 (0.64) EGLN1ADORA2A
SCHEMBL626955 0.74 EGLN1 (0.65) EGLN1ADORA2A
SCHEMBL627068 0.74 EGLN1 (0.67) EGLN1ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2603502-A1 4 - AMINOQUINAZOLIN- 2 - YL - 1 - PYRRAZOLE - 4 - CARBOXYLIC ACID COMPOUNDS AS PROLYL HYDROXYLASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2013-06-19 EP disclosed
WO-2012021830-A1 4 - AMINOQUINAZOLIN- 2 - YL - 1 - PYRRAZOLE - 4 - CARBOXYLIC ACID COMPOUNDS AS PROLYL HYDROXYLASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2012-02-16 WO disclosed