SCHEMBL7788725

SCHEMBL7788725

CN(C)C(=O)c1cccnc1CCS(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 1/20 0.38
▸ ADRA1D P25100 1/20 0.37
▸ ADRA1A P35348 1/20 0.37
▸ ADRA1B P35368 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ DDB1 Q16531 1/20 0.36
▸ CRBN Q96SW2 1/20 0.36
▸ KEAP1 Q14145 1/20 0.36
▸ HCRTR1 O43613 2/20 0.35
▸ HCRTR2 O43614 2/20 0.35
▸ NAPRT Q6XQN6 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34

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
SCHEMBL365278 0.81 ADRA1D (0.39) P2RX7ADRA1DADRA1AADRA1BMEN1
SCHEMBL12562535 0.79 MEN1 (0.42) P2RX7ADRA1DADRA1AADRA1BMEN1
SCHEMBL8847254 0.75 ALDH1A1 (0.37) P2RX7SMN1; SMN2NAPRTKCNH2
SCHEMBL30712181 0.74 SMN1; SMN2 (0.41) P2RX7ADRA1DADRA1AADRA1BMEN1
SCHEMBL12562088 0.73 P2RX7 (0.56) P2RX7ADRA1DADRA1AADRA1BMEN1
SCHEMBL23718254 0.72 HSP90AA1 (0.38) P2RX7MEN1KMT2A
SCHEMBL9244018 0.70 SMN1; SMN2 (0.40) P2RX7ADRA1DADRA1AADRA1BMEN1
SCHEMBL2705046 0.70 P2RX7 (0.41) P2RX7ADRA1DADRA1AADRA1BMEN1
SCHEMBL30151488 0.70 SMN1; SMN2 (0.40) P2RX7ADRA1DADRA1AADRA1BMEN1
SCHEMBL9358964 0.70 MEN1 (0.40) P2RX7ADRA1DADRA1AADRA1BMEN1

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-1153760-A2 Pigmented recording material having a dye-receiver layer EMTEC Magnetics GmbH (DE) 2001-11-14 — — EP disclosed
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