SCHEMBL19365349

SCHEMBL19365349

NCc1cncc(-c2ccc3c(n2)N(C(=O)Nc2cncc(F)c2)[C@H]2CCCN3C2)c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CDK9 P50750 1/20 0.35
▸ PIM2 Q9P1W9 4/20 0.35
▸ PIM3 Q86V86 2/20 0.34
▸ CLK2 P49760 2/20 0.34
▸ CLK3 P49761 2/20 0.34
▸ DYRK1A Q13627 2/20 0.34
▸ BTK Q06187 1/20 0.34
▸ ABL1 P00519 7/20 0.33
▸ EGFR P00533 1/20 0.33
▸ LCK P06239 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ PORCN Q9H237 1/20 0.33
▸ ACKR3 P25106 1/20 0.33
▸ LPL P06858 1/20 0.33
▸ LIPC P11150 1/20 0.33
▸ LIPG Q9Y5X9 1/20 0.33

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
SCHEMBL17618718 0.88 PRMT5 (0.36) PIM2CLK2CLK3DYRK1ABTK
SCHEMBL17618674 0.87 PIM2 (0.43) PIM2PIM3ABL1CYP3A4CYP2D6
SCHEMBL19365348 0.87 PIM2 (0.34) PIM2PIM3CLK2CLK3DYRK1A
SCHEMBL17618636 0.87 SCN10A (0.39) CLK2CLK3DYRK1ABTKABL1
SCHEMBL17618740 0.86 ABL1 (0.38) CLK2CLK3DYRK1AABL1
SCHEMBL17618608 0.85 SCN10A (0.38) PIM2CLK2CLK3DYRK1ABTK
SCHEMBL17618691 0.84 ABL1 (0.38) PIM2DYRK1AABL1
SCHEMBL19365550 0.84 PIM2 (0.37) PIM2PIM3
SCHEMBL19365639 0.84 PIM2 (0.38) PIM2PIM3DYRK1ABTK
SCHEMBL16754551 0.83 ROCK2 (0.38) PIM2PIM3CLK2CLK3DYRK1A

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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