SCHEMBL8969299

SCHEMBL8969299

Clc1ccc2c(c1)CN1C(=N2)C2C=CC1C2

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
ACHE P22303 1/20 0.40
CTSD P07339 4/20 0.35

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
SCHEMBL8968351 0.89 CTSD (0.46) ACHECTSD
SCHEMBL8969954 0.83 EGFR (0.34)
SCHEMBL8968403 0.83
SCHEMBL8969544 0.80 CTSD (0.39) CTSD
SCHEMBL8969502 0.78 KLK7 (0.32)
SCHEMBL8969686 0.75 PDE3B (0.45) PDE3BPDE3ACTSD
SCHEMBL8968867 0.75 MAPK1 (0.32) CTSD
SCHEMBL8969474 0.75 CTSD (0.30) CTSD
SCHEMBL8969224 0.75 CTSD (0.30) CTSD
SCHEMBL8969678 0.74 CTSD (0.39) CTSD

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
US-5486512-A LEARNING ENHANCEMENT WARNER-LAMBERT COMPANY (US) 1996-01-23 US disclosed
WO-1993003034-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1993-02-18 WO disclosed