SCHEMBL20632995

SCHEMBL20632995

C=C(Nc1cncnc1)N1CCCN(C)c2ccc(-c3cccc(C(C)(C)F)c3)nc21

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GRIN1 Q05586 1/20 0.31
▸ GRIN2B Q13224 1/20 0.31
▸ TEK Q02763 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
SCHEMBL20632922 0.92 KDM4E (0.36) —
SCHEMBL20632245 0.90 LRRK2 (0.33) TEK
SCHEMBL20633005 0.89 LMNA (0.38) —
SCHEMBL20632313 0.89 PHGDH (0.33) TEK
SCHEMBL20632519 0.88 LRRK2 (0.33) TEK
SCHEMBL20632430 0.88 HTR2C (0.40) TEK
SCHEMBL20632193 0.86 FYN (0.37) —
SCHEMBL20632940 0.85 TEK (0.33) TEK
SCHEMBL20632750 0.84 GRIN1 (0.37) GRIN1GRIN2B
SCHEMBL20632664 0.84 KDM1A (0.34) GRIN1GRIN2B

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
EP-2997029-B1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2019-01-09 — — EP disclosed
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