SCHEMBL23708307

SCHEMBL23708307

OSc1cc(-c2ccccc2)ccc1N1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ LTA4H P09960 3/20 0.40
▸ HPGD P15428 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TSHR P16473 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ HRH3 Q9Y5N1 4/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL23708148 0.78 ALOX5 (0.52) ALDH1A1KDM4ELMNAL3MBTL1HPGD
SCHEMBL23708081 0.75 KDM4E (0.43) ALDH1A1KDM4EL3MBTL1HPGDMAPK1
SCHEMBL23708502 0.75 KEAP1 (0.56) ALDH1A1KDM4ELMNAL3MBTL1HPGD
SCHEMBL23708146 0.73 RARA (0.51) ALDH1A1KDM4ELMNAL3MBTL1LTA4H
SCHEMBL23707895 0.72 KDM4E (0.63) ALDH1A1KDM4ELMNAL3MBTL1HPGD
SCHEMBL23708106 0.71 ALDH1A1 (0.43) ALDH1A1KDM4ELMNAL3MBTL1HPGD
SCHEMBL23708324 0.71 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDMAPK1TSHR
SCHEMBL16793286 0.71 AR (0.59) ALDH1A1KDM4ELMNAL3MBTL1HPGD
SCHEMBL23708171 0.71 NCF1 (0.48) ALDH1A1KDM4ELMNAL3MBTL1TSHR
SCHEMBL16793323 0.70 NCF1 (0.47) ALDH1A1KDM4ELMNAL3MBTL1TSHR

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-2021154966-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN TREATING SKIN DISORDERS KAMARI PHARMA LTD. (IL) 2021-08-05 — — WO disclosed
Send feedback