SCHEMBL20929244

SCHEMBL20929244

CCCCOC(=O)C(C)Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.54
CYP3A4 P08684 4/20 0.54
ALDH1A1 P00352 4/20 0.54
MAPK1 P28482 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
HPGD P15428 1/20 0.46
TP53 P04637 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.45
LMNA P02545 1/20 0.45
CTSK P43235 3/20 0.45
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
CTSH P09668 1/20 0.45
CHRM1 P11229 1/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 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
SCHEMBL92793 1.00 TSHR (0.54) TSHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL19248423 1.00 TSHR (0.54) TSHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL27549297 0.94 TSHR (0.54) TSHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL20269906 0.90 LMNA (0.51) TSHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL27794811 0.86 ESR1 (0.55) TSHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL16732085 0.85 TSHR (0.55) TSHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL28557095 0.84 TSHR (0.51) TSHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL2426331 0.84 TSHR (0.54) TSHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL31257795 0.83 CYP3A4 (0.55) TSHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL1892061 0.83 MMP8 (0.59) TSHRCYP3A4ALDH1A1MAPK1L3MBTL1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019076178-A1 DEGRADATION TIME CONTROLLABLE AND BREAKING ELONGATION ADJUSTABLE MEDICAL DEGRADABLE POLYURETHANE 凯斯蒂南京医疗器械有限公司 2019-04-25 WO disclosed
CN-107072250-A Paenibacillus and bacillus species mannanases 丹尼斯科美国公司 2017-08-18 CN disclosed
CN-103608356-A Detergent compositions containing bacillus agaradhaerens mannanase and methods of use thereof DANISCO US INC 2014-02-26 CN disclosed
CN-103534266-A Detergent compositions comprising GEOBACILLUS caldus (GEOBACILLUS TEPIDAMANS) mannanase and methods of use thereof DANISCO US INC 2014-01-22 CN disclosed
CN-103502445-A Detergent compositions containing bacillus sp. mannanase and methods of use thereof DANISCO US INC 2014-01-08 CN disclosed
CN-102712880-A Detergent compositions containing geobacillus stearothermophilus lipase and methods of use thereof DANISCO US INC 2012-10-03 CN disclosed
CN-102712878-A Detergent compositions containing bacillus subtilis lipase and methods of use thereof DANISCO US INC 2012-10-03 CN disclosed
CN-102712879-A Detergent compositions containing thermobifida fusca lipase and methods of use thereof DANISCO US INC 2012-10-03 CN disclosed