SCHEMBL10555665

SCHEMBL10555665

CCc1cccc2c1Oc1ccccc1N2[Si](C)(C)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 9/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MGLL Q99685 1/20 0.34
▸ P2RX1 P51575 2/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRB2 P47870 1/20 0.33
▸ HCAR1 Q9BXC0 1/20 0.32
▸ HTT P42858 3/20 0.32
▸ THRB P10828 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ P2RX3 P56373 1/20 0.31

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
SCHEMBL10558916 0.90 GABRA1 (0.37) MGLLGABRA1GABRB2HCAR1
SCHEMBL10558657 0.85 NR1H2 (0.40) —
SCHEMBL10557575 0.81 MEN1 (0.34) P2RX4
SCHEMBL10561265 0.80 P2RX4 (0.33) P2RX4
SCHEMBL10560178 0.80 P2RX4 (0.41) P2RX4P2RX1P2RX3
SCHEMBL10559856 0.80 P2RX4 (0.33) P2RX4THRBTSHR
SCHEMBL10559786 0.79 P2RX4 (0.32) P2RX4
SCHEMBL10561285 0.78 P2RX4 (0.39) P2RX4P2RX1P2RX3
SCHEMBL10560234 0.78 P2RX4 (0.38) P2RX4P2RX1P2RX3
SCHEMBL10560185 0.74 NR1H2 (0.41) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4803269-A ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1989-02-07 — — US disclosed
US-4707473-A ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1987-11-17 — — US disclosed
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