SCHEMBL6607149

SCHEMBL6607149

Cc1cc(N(C)C)c2cc(C3=NC(c4ccc5nc(C)cc(N(C)C)c5c4)N(N)C(N4CCC(O)CC4)=N3)ccc2n1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TERT O14746 3/20 0.34
CLK2 P49760 1/20 0.33
CLK3 P49761 1/20 0.33
DYRK1A Q13627 1/20 0.33
ATM Q13315 1/20 0.32
NPY5R Q15761 1/20 0.31
SMPD3 Q9NY59 1/20 0.31
KMT2A Q03164 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
SCHEMBL6605139 0.95 TERT (0.33) TERTCLK2CLK3DYRK1AATM
SCHEMBL6599497 0.90 SMPD3 (0.35) TERTSMPD3KMT2A
SCHEMBL4074857 0.90 TERT (0.35) TERT
SCHEMBL6591832 0.89 CLK2 (0.35) TERTCLK2CLK3DYRK1AATM
SCHEMBL6594969 0.87 MEN1 (0.36) TERTKMT2A
SCHEMBL4082014 0.86 ACVR1 (0.34) TERT
SCHEMBL4076584 0.86 TERT (0.33) TERT
SCHEMBL6591886 0.86 BRD4 (0.37)
SCHEMBL6592153 0.85 BMPR1B (0.38) TERT
SCHEMBL4076912 0.84 TLR9 (0.37) TERT

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-1373252-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT Aventis Pharma S.A. (FR) 2004-01-02 EP disclosed
WO-2002076975-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT AVENTIS PHARMA S.A. (FR) 2002-10-03 WO disclosed