SCHEMBL3977577

SCHEMBL3977577

COCOCCCNc1[c]ccc(N(C)CCN(C)C)c1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.31
MTNR1B P49286 1/20 0.31

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
SCHEMBL589736 0.85 CYP2D6 (0.32) MTNR1AMTNR1B
SCHEMBL589453 0.73 ALDH1A1 (0.33)
SCHEMBL28044597 0.72 USP2 (0.30)
SCHEMBL591196 0.69 ALDH1A1 (0.32)
SCHEMBL592164 0.68
SCHEMBL591061 0.63 NOS1 (0.38)
SCHEMBL12466363 0.62 MTNR1A (0.35) MTNR1AMTNR1B
SCHEMBL591101 0.61 MLYCD (0.36)
SCHEMBL591483 0.61 HTR1D (0.32)
SCHEMBL3123962 0.59 NPC1 (0.46)

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-2120932-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Nerviano Medical Sciences S.r.l. (IT) 2009-11-25 EP disclosed
WO-2008074749-A9 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2009-05-07 WO disclosed
WO-2008074749-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-26 WO disclosed