SCHEMBL22101348

SCHEMBL22101348

CCC(=O)CC(=O)OCCS

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.43
GAA P10253 2/20 0.41
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
NAAA Q02083 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
DGKA P23743 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
DNM1 Q05193 1/20 0.32
ADRA2A P08913 1/20 0.31
ADRA1A P35348 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SOAT1 P35610 1/20 0.31
HTR2C P28335 1/20 0.31
MAPT P10636 1/20 0.30
BLM P54132 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
SCHEMBL6669031 0.82 FAAH (0.50) FAAHGAAMGAMSIMGAM2
SCHEMBL720722 0.81
SCHEMBL11168290 0.81 MGAM (0.46) FAAHGAAMGAMSIMGAM2
SCHEMBL7625698 0.80 GAA (0.68) FAAHGAAMGAMSIMGAM2
SCHEMBL27940082 0.80 FAAH (0.48) FAAHGAAMGAMSIMGAM2
SCHEMBL7352582 0.79 DNM1 (0.53) FAAHGAAMGAMSIMGAM2
SCHEMBL31634148 0.78 FAAH (0.43) FAAHGAAMGAMSIMGAM2
SCHEMBL29467312 0.78 FAAH (0.61) FAAHNAAATDP1TSHRDGKA
SCHEMBL648799 0.78 FAAH (0.61) FAAHNAAATDP1TSHRDGKA
SCHEMBL10399312 0.77 GAA (0.50) FAAHGAAMGAMSIMGAM2

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
EP-3666772-A1 DIARYLTHIOHYDANTOIN COMPOUND AS ANDROGEN RECEPTOR ANTAGONIST Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2020-06-17 EP disclosed
CN-1025582-C Azole pesticides SCHERING AGROCHEMICALS LTD (GB) 1994-08-10 CN disclosed