SCHEMBL7053852

SCHEMBL7053852

C[CH]Sc1ccccc1OCCl

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ PTGS2 P35354 1/20 0.30
▸ SLC6A9 P48067 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
SCHEMBL8429705 0.83 ALDH1A1 (0.47) HPGD
SCHEMBL7056770 0.76 CA1 (0.50) —
SCHEMBL7690167 0.72 KDM4E (0.46) KDM4EHPGDSMN1; SMN2
SCHEMBL7050103 0.72 IRAK4 (0.41) KDM4ESMN1; SMN2
SCHEMBL7053251 0.71 KDM4E (0.34) KDM4EHPGDSMN1; SMN2
SCHEMBL1264053 0.71 ALDH1A1 (0.45) KDM4EHPGDSMN1; SMN2
SCHEMBL8893668 0.67 CA12 (0.62) HPGDSMN1; SMN2
SCHEMBL1705449 0.67 TSHR (0.41) KDM4EHPGD
SCHEMBL7049447 0.67 ALDH1A1 (0.35) KDM4EHPGDSMN1; SMN2
SCHEMBL6205320 0.67 ALDH1A1 (0.52) KDM4EHPGDSMN1; SMN2

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-6608070-B1 Useful for treatment of medical condition in which prostaglandins are implicated as pathogens NAKAO KAZUNARI (JP) 2003-08-19 — — US disclosed
EP-1304325-A1 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-04-23 — — EP disclosed
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