SCHEMBL28193442

SCHEMBL28193442

[CH2]c1cnc(CC(C)=O)[nH]1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 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
SCHEMBL28193948 0.81 KDM6B (0.31) —
SCHEMBL28296067 0.72 MMP2 (0.58) —
SCHEMBL28306548 0.68 SRC (0.34) —
SCHEMBL2648605 0.64 — —
SCHEMBL12824634 0.63 QPCT (0.32) —
SCHEMBL11983587 0.63 PIM1 (0.33) —
SCHEMBL4765262 0.61 HTT (0.40) POLB
SCHEMBL27960124 0.61 P4HTM (0.42) POLB
SCHEMBL27960128 0.61 ESR1 (0.32) POLB
SCHEMBL11983451 0.61 GLA (0.52) —

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
CN-107531714-A Imidazopyrazines ketone as PDE1 inhibitor H.隆德贝克有限公司 2018-01-02 — — CN disclosed
Send feedback