SCHEMBL23226844

SCHEMBL23226844

Cc1cc(NC(=O)c2ccc(-c3ccc(C(F)(F)F)cc3Cl)cc2)ccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 2/20 0.48
▸ P2RX4 Q99571 2/20 0.48
▸ P2RX7 Q99572 2/20 0.48
▸ TMPRSS4 Q9NRS4 2/20 0.48
▸ IL2 P60568 1/20 0.47
▸ DHODH Q02127 1/20 0.46
▸ TRPV1 Q8NER1 6/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ LMNA P02545 2/20 0.46
▸ SLC2A1 P11166 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SLC1A3 P43003 1/20 0.45
▸ SLC1A2 P43004 1/20 0.45
▸ SLC1A1 P43005 1/20 0.45
▸ KCNK3 O14649 2/20 0.45
▸ KCNK9 Q9NPC2 1/20 0.45
▸ PTPN1 P18031 1/20 0.44

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
SCHEMBL23226848 0.88 APP (0.48) P2RX1P2RX4P2RX7TMPRSS4IL2
SCHEMBL23226443 0.83 KMT2A (0.49) P2RX1P2RX4P2RX7TMPRSS4IL2
SCHEMBL23226421 0.83 STING1 (0.47) P2RX1P2RX4P2RX7TMPRSS4IL2
SCHEMBL23226420 0.83 MEN1 (0.43) P2RX1P2RX4P2RX7TMPRSS4IL2
SCHEMBL23226814 0.82 HDAC3 (0.53) P2RX1TMPRSS4TRPV1MEN1KMT2A
SCHEMBL23226438 0.82 STING1 (0.48) P2RX1P2RX4P2RX7TMPRSS4IL2
SCHEMBL23226444 0.82 MEN1 (0.60) P2RX1P2RX4P2RX7TMPRSS4IL2
SCHEMBL23226430 0.82 STING1 (0.46) P2RX1P2RX4P2RX7TMPRSS4IL2
SCHEMBL23226707 0.81 STING1 (0.47) P2RX1P2RX4P2RX7TMPRSS4IL2
SCHEMBL30116622 0.81 ALDH1A1 (0.50) P2RX1P2RX4P2RX7TMPRSS4IL2

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
WO-2021068950-A1 AMIDE COMPOUND AND MEDICAL USE THEREOF AS STING INHIBITOR 中国药科大学 2021-04-15 — — WO disclosed
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