SCHEMBL23472223

SCHEMBL23472223

CCC(C)[C@H](CCO)Nc1nc(C)ncc1OC

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 5/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ MITF O75030 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ P2RX3 P56373 1/20 0.31
▸ P2RX2 Q9UBL9 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ FYN P06241 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
SCHEMBL23472142 0.86 TRPM8 (0.44) TRPM8L3MBTL1MITFLMNAMAPT
SCHEMBL15470343 0.86 TRPM8 (0.44) TRPM8L3MBTL1MITFLMNAMAPT
SCHEMBL19274227 0.86 TRPM8 (0.44) TRPM8L3MBTL1MITFLMNAMAPT
SCHEMBL23472468 0.83 TRPM8 (0.42) TRPM8L3MBTL1MITFLMNAMAPT
SCHEMBL20219410 0.79 TRPM8 (0.46) TRPM8L3MBTL1MITFLMNAMAPT
SCHEMBL20413265 0.78 CRHR1 (0.43) TRPM8MAPTSMN1; SMN2POLBP2RX3
SCHEMBL23472645 0.76 TRPM8 (0.40) TRPM8L3MBTL1MITFLMNAMAPT
SCHEMBL13195755 0.76 TRPM8 (0.40) TRPM8L3MBTL1MITFLMNAMAPT
SCHEMBL20219325 0.76 TRPM8 (0.40) TRPM8L3MBTL1MITFLMNAMAPT
SCHEMBL20219343 0.75 TRPM8 (0.34) TRPM8TLR8TLR7

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-3590928-B1 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF VIRAL INFECTIONS JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2021-06-09 — — EP disclosed
Send feedback