SCHEMBL5170687

SCHEMBL5170687

c1cc2c[nH]c3sc4cncnc4c3c-2c1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.37
MAPK1 P28482 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
SCHEMBL5243145 0.76 LIMK1 (0.34) LIMK1
SCHEMBL5244491 0.73 LIMK1 (0.61) LIMK1
SCHEMBL5245414 0.69 PIM1 (0.48)
SCHEMBL16751693 0.67 GABRA1 (0.48)
SCHEMBL16751768 0.66 GABRA1 (0.42) LIMK1
SCHEMBL17117837 0.65 ALDH1A1 (0.41) LIMK1
SCHEMBL25461826 0.64 LMNA (0.40) LIMK1
SCHEMBL17917464 0.64 EGFR (0.31) LIMK1
SCHEMBL16751602 0.63 GABRA1 (0.46)
SCHEMBL2301375 0.63

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-1773840-A1 SUBSTITUTED PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDINES AND PYRIDO[3',2':4,5]FURO[3,2-D]-PYRIMIDINES FOR USE AS INHIBITORS OF PDA-4 AND/OR TNF-ALPHA RELEASE Curacyte Discovery GmbH (DE) 2007-04-18 EP claimed
WO-2006010567-A1 SUBSTITUTED PYRIDO[3', 2': 4, 5]THIENO[3,2-D]PYRIMIDINES AND PYRIDO[3', 2': 4, 5]FURO[3, 2, D]PYRIMIDINES USED AS INHIBITORS OF THE PDE-4 AND/OR THE RELEASE OF TNF$G(A) CURACYTE DISCOVERY GMBH (DE) 2006-02-02 WO claimed