SCHEMBL19365572

SCHEMBL19365572

Nc1ccc(-c2cccc(C(F)(F)F)c2)nc1N(C(=O)Nc1nnc(-c2ccncc2)s1)C1CCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BLM P54132 5/20 0.45
▸ MAPK10 P53779 4/20 0.41
▸ MAPK8 P45983 3/20 0.41
▸ KDM4E B2RXH2 5/20 0.39
▸ HPGD P15428 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ IDE P14735 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ WRN Q14191 1/20 0.39
▸ CSNK2A2 P19784 1/20 0.38
▸ CSNK2B P67870 1/20 0.38
▸ CSNK2A1 P68400 1/20 0.38
▸ CSNK2A3 Q8NEV1 1/20 0.38
▸ USP2 O75604 3/20 0.38
▸ USP8 P40818 3/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37

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
SCHEMBL19365636 0.85 POLB (0.46) ALDH1A1KMT2AMEN1POLB
SCHEMBL19365609 0.83 TRPV1 (0.46) MAPK1
SCHEMBL19706061 0.82 KDM1A (0.41) SMN1; SMN2ALDH1A1MAPK1CSNK2A2CSNK2B
SCHEMBL19670421 0.81 MPL (0.44) ALDH1A1KMT2AMEN1POLBMPL
SCHEMBL19365722 0.80 POLB (0.41) POLB
SCHEMBL21841343 0.80 KMO (0.41) ALDH1A1KMT2AMEN1POLB
SCHEMBL19365630 0.80 CTSK (0.38) —
SCHEMBL19365519 0.80 POLB (0.46) KMT2AMEN1POLB
SCHEMBL19365521 0.80 POLB (0.39) ALDH1A1KMT2AMEN1POLB
SCHEMBL19670601 0.79 POLB (0.41) ALDH1A1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9765075-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-09-19 — — US disclosed
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