SCHEMBL1618569

SCHEMBL1618569

CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4CCCC(O)(O)[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 5/20 0.54
HSD17B10 Q99714 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
EPHA2 P29317 3/20 0.54
AKR1B10 O60218 2/20 0.54
AKR1B1 P15121 2/20 0.54
LMNA P02545 2/20 0.54
EFNA1 P20827 1/20 0.54
PSEN1 P49768 1/20 0.54
PSEN2 P49810 1/20 0.54
APH1B Q8WW43 1/20 0.54
NCSTN Q92542 1/20 0.54
APH1A Q96BI3 1/20 0.54
PSENEN Q9NZ42 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
CASP7 P55210 3/20 0.48
TP53 P04637 2/20 0.48
MAPK1 P28482 2/20 0.48
BLM P54132 2/20 0.48

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
SCHEMBL19064920 0.91 GPBAR1 (0.54) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL7514775 0.89 CYP2D6 (0.62) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL19064993 0.89 GPBAR1 (0.53) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL9664069 0.89 CYP2D6 (0.62) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL4751618 0.87 GPBAR1 (0.74) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL9580113 0.87 GPBAR1 (0.51) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL381612 0.87 GPBAR1 (0.74) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL10906860 0.87 GPBAR1 (0.74) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL7124131 0.86 GPBAR1 (0.49) GPBAR1HSD17B10TDP1EPHA2AKR1B10
SCHEMBL1492255 0.86 GPBAR1 (0.49) GPBAR1HSD17B10TDP1EPHA2AKR1B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110314166-A Application of the Tauro ursodesoxy cholic acid in anti-hand-foot-and-mouth-disease poison and vesicular stomatitis virus drug 武汉大学 2019-10-11 CN disclosed
CN-105891351-B A kind of new Tauro ursodesoxy cholic acid content and the detection method in relation to substance 中山百灵生物技术有限公司 2019-03-01 CN disclosed
CN-104382911-B Application of the Tauro ursodesoxy cholic acid salt as active component in treatment Echinococcus Granulosus Cysts medicine is prepared 姜玉峰 2017-09-15 CN disclosed
CN-106031731-A New uses of tauroursodeoxycholic acid 中国医学科学院基础医学研究所 2016-10-19 CN disclosed
CN-105699501-A Method for detecting impurities in tauroursodeoxycholic acid through high performance liquid chromatograph 成都欣捷高新技术开发有限公司 2016-06-22 CN disclosed
CN-103445007-B Tauro ursodesoxy cholic acid is alleviating the application in chicken heat shock as feed addictive SOUTH CHINA AGRICULTURAL UNIVERSITY (CN) 2015-09-30 CN disclosed
US-9085602-B1 Facial amphiphiles and methods of use THE SCRIPPS RESEARCH INSTITUTE (US) 2015-07-21 US disclosed
CN-104382911-A Application of tauroursodeoxycholic acid salt used as active ingredient in preparation of drug for treating echinococcosis JIANG YUFENG 2015-03-04 CN disclosed
US-7922998-B2 bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy BRACCO IMAGING S.P.A. (IT) 2011-04-12 US disclosed
US-20060018830-A1 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2006-01-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060018830-A1 Gastrin releasing peptide compounds GRPR, GIPR, CCKBR GPBAR1 9/4885HSD17B10 4843/4885TDP1 4633/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.