SCHEMBL4822683

SCHEMBL4822683

CCOC(=O)C1Cc2ccccc2CC1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.46
NR1D1 P20393 3/20 0.44
RAB9A P51151 1/20 0.43
LMNA P02545 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL8401366 1.00 MAPT (0.47) MAPTPKMTSHRNR1D1RAB9A
SCHEMBL8401362 1.00 MAPT (0.47) MAPTPKMTSHRNR1D1RAB9A
SCHEMBL14193309 0.93 NR1D1 (0.48) MAPTPKMTSHRNR1D1RAB9A
SCHEMBL4815395 0.93 NR1D1 (0.48) MAPTPKMTSHRNR1D1RAB9A
SCHEMBL8397951 0.86 ALDH1A1 (0.47) MAPTPKMTSHRNR1D1RAB9A
SCHEMBL8397958 0.86 ALDH1A1 (0.47) MAPTPKMTSHRNR1D1RAB9A
SCHEMBL8397955 0.86 ALDH1A1 (0.47) MAPTPKMTSHRNR1D1RAB9A
SCHEMBL14193303 0.83 NR1D1 (0.43) MAPTPKMTSHRNR1D1KDM4E
SCHEMBL8399607 0.83 FABP7 (0.50) TSHRRAB9AALDH1A1GAAHPGD
SCHEMBL10738463 0.81 MMP3 (0.46) MAPTMEN1GAAKMT2A

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
US-7365061-B2 2-Amino-3-functionalized tetralin derivatives and related glycogen phosphorylase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-04-29 US disclosed
WO-2006055463-A2 2-AMINO-3-FUNCTIONALIZED TETRALIN DERIVATIVES AND RELATED GLYCOGEN PHOSPHORYLASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-05-26 WO disclosed
US-20060111413-A1 Antidiabetic agents, anticancer, non-cardiac ischemia, infection, hypertension, obesity and dislipidemia; 3-(5-chloroindole-2-carbonylamino)-2-hydroxy-1,2,3,4-tetrahydronaphthalene BRISTOL-MYERS SQUIBB COMPANY 2006-05-25 US disclosed
US-5869518-A USEFUL IN THE TREATMENT OF OBESITY AND HYPERGLYCEMIA SYNTHELABO (FR) 1999-02-09 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-20060111413-A1 Antidiabetic agents, anticancer, non-cardiac ischemia, infection, hypertension, obesity and dislipidemia; 3-(5-chloroindole-2-carbonylamino)-2-hydroxy-1,2,3,4-tetrahydronaphthalene PYGM, PON1, GYS1 MAPT 3207/4885PKM 1175/4885TSHR 2965/4885

“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.