SCHEMBL28318092

SCHEMBL28318092

COC(=O)c1ccccc1C(=O)OC(C)(C)C

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.57
TSHR P16473 2/20 0.57
ALDH1A1 P00352 3/20 0.55
CFTR P13569 1/20 0.55
HSD17B10 Q99714 1/20 0.55
KDM4E B2RXH2 2/20 0.53
POLB P06746 1/20 0.53
ATM Q13315 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA5A P35218 1/20 0.53
CA9 Q16790 1/20 0.53
KMT2A Q03164 2/20 0.49
MAPT P10636 1/20 0.49
ALOX15 P16050 1/20 0.49
SLC6A3 Q01959 4/20 0.47
MYC P01106 1/20 0.47
SLC6A4 P31645 2/20 0.46
GLA P06280 1/20 0.46

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
SCHEMBL30111657 0.92 TSHR (0.50) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL109178 0.92 TSHR (0.50) LMNATSHRALDH1A1CFTRHSD17B10
Hydrogen Peroxide SCHEMBL29048859 0.90 TSHR (0.48) LMNATSHRALDH1A1HSD17B10KMT2A
SCHEMBL28236597 0.87 LMNA (0.52) LMNATSHRALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL4913999 0.85 TSHR (0.63) LMNATSHRALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL34630 0.85 TSHR (0.74) LMNATSHRALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL29669976 0.85 TSHR (0.74) LMNATSHRALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL790124 0.85 TSHR (0.74) LMNATSHRALDH1A1CFTRHSD17B10
Dimethyl Phthalate SCHEMBL29500970 0.85 TSHR (0.74) LMNATSHRALDH1A1CFTRHSD17B10
SCHEMBL10514026 0.84 TSHR (0.44) LMNATSHRALDH1A1HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113841767-A Bullet-proof coffee containing defatted whole soybean milk and preparation method and device thereof 祖名豆制品股份有限公司 2021-12-28 CN claimed
CN-113841767-A Bullet-proof coffee containing defatted whole soybean milk and preparation method and device thereof 祖名豆制品股份有限公司 2021-12-28 CN disclosed
CN-110256427-A 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2019-09-20 CN disclosed
CN-110204544-A 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2019-09-06 CN disclosed