SCHEMBL2500897

SCHEMBL2500897

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.46
HIF1A Q16665 4/20 0.45
ADRB1 P08588 2/20 0.45
ADRA1A P35348 2/20 0.45
RAB9A P51151 2/20 0.45
ADRB2 P07550 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
ADRB3 P13945 1/20 0.45
TSHR P16473 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45
NFKB1 P19838 1/20 0.45
DRD1 P21728 1/20 0.45
HTR7 P34969 1/20 0.45
ADRA1B P35368 1/20 0.45
DRD3 P35462 1/20 0.45
SLC6A3 Q01959 1/20 0.45
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 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
SCHEMBL2499538 1.00 KCNA5 (0.46) KCNA5HIF1AADRB1ADRA1ARAB9A
SCHEMBL8564623 0.84 CA12 (0.44) HIF1AADRB1ADRA1ARAB9AADRB2
SCHEMBL2498065 0.84 KCNA5 (0.47) KCNA5HIF1AADRB1ADRA1ARAB9A
SCHEMBL11078770 0.84 ALDH1A1 (0.42) HIF1AADRB1ADRA1ALMNAKDM4E
SCHEMBL27830813 0.84 KCNA5 (0.47) KCNA5HIF1AADRB1ADRA1ARAB9A
SCHEMBL2504421 0.84 KCNA5 (0.47) KCNA5HIF1AADRB1ADRA1ARAB9A
SCHEMBL20280086 0.84 KCNA5 (0.46) KCNA5RAB9AGAAMAPTALDH1A1
SCHEMBL13882102 0.84 HIF1A (0.57) HIF1AADRB1ADRA1ARAB9AADRB2
SCHEMBL22303913 0.83 HDAC4 (0.47) KCNA5LMNAKDM4EGAAMAPT
SCHEMBL11475728 0.83 L3MBTL1 (0.56)

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 1121/4885HIF1A 1225/4885ADRB1 59/4885

“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.