SCHEMBL8969686

SCHEMBL8969686

Clc1ccc2c(c1Cl)CN1C(=N2)C2C=CC1C2

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.45
PDE3A Q14432 2/20 0.45
MEN1 O00255 1/20 0.40
PDE2A O00408 1/20 0.40
KMT2A Q03164 1/20 0.40
P2RY12 Q9H244 1/20 0.40
CTSD P07339 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
SCHEMBL8969650 0.86 PDE3B (0.33) PDE3BPDE3A
SCHEMBL8969596 0.86 PDE3B (0.33) PDE3BPDE3A
SCHEMBL8968716 0.83 CTSD (0.46) PDE3BPDE3ACTSD
SCHEMBL8969806 0.80
SCHEMBL8969184 0.78
SCHEMBL8969688 0.78 PDE3B (0.34) PDE3BPDE3A
SCHEMBL8968414 0.77 ACHE (0.36) PDE3BPDE3A
SCHEMBL8969469 0.76
SCHEMBL8969615 0.75 CTSD (0.30) CTSD
SCHEMBL8969299 0.75 PDE3B (0.40) PDE3BPDE3ACTSD

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