SCHEMBL2498065

SCHEMBL2498065

COC(=O)C[C@H](c1cccc(O)c1)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.47
ADRB1 P08588 2/20 0.45
ADRA1A P35348 2/20 0.45
MIF P14174 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2B P41595 1/20 0.45
HIF1A Q16665 4/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
SLC22A1 O15245 1/20 0.44
OPRM1 P35372 1/20 0.44
RAB9A P51151 2/20 0.43
ADRB2 P07550 1/20 0.43
HTR1A P08908 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRB3 P13945 1/20 0.43
TSHR P16473 1/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
NFKB1 P19838 1/20 0.43

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
SCHEMBL27830813 1.00 KCNA5 (0.47) KCNA5ADRB1ADRA1AMIFHTR2A
SCHEMBL2504421 1.00 KCNA5 (0.47) KCNA5ADRB1ADRA1AMIFHTR2A
SCHEMBL2500897 0.84 KCNA5 (0.46) KCNA5ADRB1ADRA1AMIFHTR2A
SCHEMBL2499538 0.84 KCNA5 (0.46) KCNA5ADRB1ADRA1AMIFHTR2A
SCHEMBL3658148 0.83 HIF1A (0.51) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL3658580 0.83 HIF1A (0.51) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL5522123 0.82 KCNA5 (0.64) KCNA5RAB9AMAPT
SCHEMBL9909376 0.82 KCNA5 (0.64) KCNA5RAB9AMAPT
SCHEMBL13882102 0.81 HIF1A (0.57) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL2431870 0.81 KCNA5 (0.48) KCNA5ADRA1ALMNAOPRM1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
US-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
US-8030354-B2 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes AMGEN INC. (US) 2011-10-04 US disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 US disclosed
US-20090137561-A1 Substituted biphenyl GPR40 modulators AMGEN INC. (US) 2009-05-28 US disclosed
WO-2009048527-A1 SUBSTITUTED BIPHENYL GPR40 MODULATORS AMGEN INC. (US) 2009-04-16 WO 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-20090137561-A1 Substituted biphenyl GPR40 modulators GPR119, GPR65, GPR55 KCNA5 1121/4885ADRB1 59/4885ADRA1A 180/4885

“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.