SCHEMBL9038448

SCHEMBL9038448

O=c1[nH]c2cc3ncncc3cc2s1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 5/20 0.42
PDE3A Q14432 5/20 0.42
CMA1 P23946 1/20 0.39
EGFR P00533 9/20 0.37
MKNK1 Q9BUB5 2/20 0.34
PGR P06401 1/20 0.34

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
SCHEMBL30035692 0.75 GRIN2D (0.44) EGFR
SCHEMBL18719389 0.69 EGFR (0.40) EGFR
SCHEMBL7687471 0.69 KMO (0.45) PDE3BPDE3AEGFR
SCHEMBL8874014 0.69 EGFR (0.58) EGFR
SCHEMBL338446 0.69 PDE3B (0.49) PDE3BPDE3ACMA1MKNK1
SCHEMBL6017066 0.68 KDM4E (0.44) EGFR
SCHEMBL26423685 0.68 EGFR (0.39) EGFR
SCHEMBL4430364 0.68 PDE3B (0.41) PDE3BPDE3ACMA1PGR
SCHEMBL4427818 0.68 CMA1 (0.38) PDE3BPDE3ACMA1MKNK1PGR
SCHEMBL28673518 0.67 PDE3B (0.36) PDE3BPDE3ACMA1MKNK1

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-0741711-A1 TRICYCLIC COMPOUNDS CAPABLE OF INHIBITING TYROSINE KINASES OF THE EPIDERMAL GROWTH FACTOR RECEPTOR FAMILY WARNER-LAMBERT COMPANY (US) 1996-11-13 EP disclosed
WO-1995019970-A1 TRICYCLIC COMPOUNDS CAPABLE OF INHIBITING TYROSINE KINASES OF THE EPIDERMAL GROWTH FACTOR RECEPTOR FAMILY WARNER-LAMBERT COMPANY (US) 1995-07-27 WO disclosed