SCHEMBL7589406

SCHEMBL7589406

CCN(c1ccccc1)c1nc(C)cc(Cl)n1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
CRHBP P24387 1/20 0.51
CRHR2 Q13324 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CRHR1 P34998 11/20 0.44
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.42
HCN1 O60741 2/20 0.41
HCN4 Q9Y3Q4 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL7511418 0.90 MAPT (0.57) MAPTCRHBPCRHR2NPSR1TP53
SCHEMBL7504044 0.81 MAPT (0.51) MAPTCRHBPCRHR2NPSR1TP53
SCHEMBL13752166 0.79 MAPT (0.73) MAPTCRHBPCRHR2NPSR1TP53
SCHEMBL9878999 0.79 LMNA (0.50) MAPTLMNAL3MBTL1HTTKMT2A
SCHEMBL9004423 0.78 ALDH1A1 (0.63) MAPTCRHBPCRHR2NPSR1TP53
SCHEMBL7503109 0.78 MAPT (0.50) MAPTCRHBPCRHR2NPSR1TP53
SCHEMBL8894118 0.76 L3MBTL1 (0.52) MAPTCRHBPCRHR2NPSR1TP53
SCHEMBL9811161 0.75 MAPT (0.58) MAPTCRHBPCRHR2NPSR1TP53
SCHEMBL20476321 0.74 TDP1 (0.46) MAPTLMNACRHR1HTTKMT2A
SCHEMBL8795503 0.74 LMNA (0.45) MAPTNPSR1LMNAL3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1206265-A4 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO INC (US) 2002-08-07 EP disclosed
EP-1206265-A1 SRC KINASE INHIBITOR COMPOUNDS Merck & Co., Inc. (US) 2002-05-22 EP disclosed
WO-2001000213-A1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO., INC. (US) 2001-01-04 WO disclosed