SCHEMBL29033928

SCHEMBL29033928

O=C(CCl)CSc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.63
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
ALDH1A1 P00352 4/20 0.46
LMNA P02545 3/20 0.45
HTT P42858 3/20 0.45
NPC1 O15118 4/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
FKBP1A P62942 1/20 0.45
HSD17B10 Q99714 1/20 0.45
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RECQL P46063 1/20 0.44
MAPK1 P28482 1/20 0.44
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HPGD P15428 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 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
SCHEMBL9179407 0.87 FFAR1 (0.74) FFAR1ALDH1A1LMNAHTTNPC1
SCHEMBL8628476 0.79 FFAR1 (0.63) FFAR1ALDH1A1LMNAHTTNPC1
SCHEMBL7983926 0.79 FFAR1 (0.69) FFAR1MTNR1AMTNR1BALDH1A1LMNA
SCHEMBL5593977 0.79 FFAR1 (0.63) FFAR1ALDH1A1LMNAHTTNPC1
SCHEMBL13461018 0.79 FFAR1 (0.63) FFAR1MTNR1AMTNR1BALDH1A1LMNA
SCHEMBL153461 0.78 FFAR1 (0.68) FFAR1ALDH1A1LMNAHTTNPC1
SCHEMBL74365 0.78 FFAR1 (1.00) FFAR1ALDH1A1LMNAHTTNPC1
SCHEMBL10967471 0.78 FFAR1 (0.67) FFAR1ALDH1A1LMNAHTTNPC1
SCHEMBL2210143 0.78 FFAR1 (0.61) FFAR1MTNR1AMTNR1BALDH1A1LMNA
SCHEMBL15571433 0.76 FFAR1 (0.95) FFAR1ALDH1A1LMNAHTTNPC1

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
CN-116034126-A Holographic recording material and preparation method thereof 科罗拉多大学评议会公司 2023-04-28 CN disclosed