SCHEMBL20600668

SCHEMBL20600668

COc1cc(B2OC(C)(C)C(C)(C)O2)cc(OC)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
PKM P14618 2/20 0.40
CA12 O43570 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
LMNA P02545 1/20 0.40
CSF1R P07333 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
LPL P06858 4/20 0.38
LIPG Q9Y5X9 4/20 0.38
PTPN1 P18031 1/20 0.38

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
SCHEMBL15356534 0.90 CSF1R (0.39) CA1CA2CA9PKMCA12
SCHEMBL529553 0.89 MEN1 (0.39) LMNACSF1RMAPTKMT2ALPL
SCHEMBL15191096 0.89 ALOX5 (0.40) CA1CA2CA9CSF1RLPL
SCHEMBL7167240 0.85 ERN1 (0.53) LMNAMAPT
SCHEMBL21428445 0.85 LMNA (0.42) CA1CA2CA9PKMCA12
SCHEMBL22726982 0.83 CSF1R (0.43) CA1CA2CA9CA12CA3
SCHEMBL2278746 0.83 ACHE (0.43) CA1CA2CA9CSF1RMAPT
SCHEMBL9401 0.81 MAOB (0.47) CA1CA2CA9CSF1RKMT2A
SCHEMBL26110064 0.80 CYP3A4 (0.42) CA1CA2CA9LMNACSF1R
SCHEMBL20562111 0.80 CA1 (0.44) CA1CA2CA9PKMCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200369665-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR Ryvu Therapeutics S.A. (PL) 2020-11-26 US disclosed
EP-3645536-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR Ryvu Therapeutics S.A. (PL) 2020-05-06 EP disclosed
WO-2019002606-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR SELVITA S.A. (PL) 2019-01-03 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-20200369665-A1 IMIDAZO[1,2-A]PYRAZINE MODULATORS OF THE ADENOSINE A2A RECEPTOR ADORA2A, ADORA1, ADORA3 CA1 2089/4885CA2 783/4885CA9 3990/4885

“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.