SCHEMBL17276010

SCHEMBL17276010

COc1ccc(-c2ccc(OC)nc2OC)c(OC)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 2/20 0.56
BRD7 Q9NPI1 2/20 0.56
POLB P06746 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
CYP1A2 P05177 2/20 0.48
METAP2 P50579 1/20 0.48
ERN1 O75460 2/20 0.47
PRKAG1 P54619 1/20 0.46
PRKAA1 Q13131 1/20 0.46
PRKAB1 Q9Y478 1/20 0.46
CRHR1 P34998 1/20 0.45
PLAU P00749 1/20 0.44
POLQ O75417 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
PDE10A Q9Y233 2/20 0.39
SIRT2 Q8IXJ6 1/20 0.38
SIRT1 Q96EB6 1/20 0.38
NNMT P40261 1/20 0.38
KMT2A Q03164 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
SCHEMBL31438401 1.00 BRD9 (0.56) BRD9BRD7POLBTDP1CYP1A2
SCHEMBL10094647 0.84 BRD9 (0.52) BRD9BRD7POLBTDP1CYP1A2
SCHEMBL13500512 0.82 BRD9 (0.47) BRD9BRD7POLBTDP1ERN1
SCHEMBL14536130 0.80 BRD9 (0.52) BRD9BRD7POLBTDP1CYP1A2
SCHEMBL10094340 0.80 BRD9 (0.49) BRD9BRD7POLBTDP1CYP1A2
SCHEMBL2037315 0.80 ERN1 (0.49) BRD9BRD7POLBTDP1CYP1A2
SCHEMBL10094683 0.79 PDE2A (0.44) BRD9BRD7POLBTDP1CYP1A2
SCHEMBL28789059 0.79 ERN1 (0.42) BRD9BRD7POLBTDP1CYP1A2
SCHEMBL7708425 0.79 ERN1 (0.51) BRD9BRD7POLBTDP1CYP1A2
SCHEMBL22621616 0.78 POLB (0.52) BRD9BRD7POLBTDP1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3710422-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY AND DIASTEREOMERICALLY ENRICHED CYCLOBUTANE AMINES AND AMIDES Syngenta Participations AG (CH) 2020-09-23 EP claimed
WO-2015178846-A1 PROCESS FOR THE PREPARATION OF CHIRAL AMINES FROM PROCHIRAL KETONES SP PROCESS DEVELOPMENT AB (SE) 2015-11-26 WO claimed
WO-2015178847-A1 PROCESS FOR THE PREPARATION OF CHIRAL AMINES BY ASYMMETRIC HYDROGENATION OF PROCHIRAL OXIMES SP PROCESS DEVELOPMENT AB (SE) 2015-11-26 WO claimed
US-11053188-B2 Process for the preparation of enantiomerically and diastereomerically enriched cyclobutane amines and amides SYNGENTA PARTICIPATIONS AG (CH) 2021-07-06 US disclosed
US-20200407311-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY AND DIASTEREOMERICALLY ENRICHED CYCLOBUTANE AMINES AND AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2020-12-31 US disclosed
EP-3710422-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY AND DIASTEREOMERICALLY ENRICHED CYCLOBUTANE AMINES AND AMIDES Syngenta Participations AG (CH) 2020-09-23 EP disclosed
WO-2015178846-A1 PROCESS FOR THE PREPARATION OF CHIRAL AMINES FROM PROCHIRAL KETONES SP PROCESS DEVELOPMENT AB (SE) 2015-11-26 WO disclosed
WO-2015178847-A1 PROCESS FOR THE PREPARATION OF CHIRAL AMINES BY ASYMMETRIC HYDROGENATION OF PROCHIRAL OXIMES SP PROCESS DEVELOPMENT AB (SE) 2015-11-26 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 (2 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-20200407311-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY AND DIASTEREOMERICALLY ENRICHED CYCLOBUTANE AMINES AND AMIDES TBCB, ADORA2B, ADRA2B BRD9 2552/4885BRD7 1094/4885POLB 243/4885
US-11053188-B2 Process for the preparation of enantiomerically and diastereomerically enriched cyclobutane amines and amides TBCB, ADORA2B, CCNB3 BRD9 2484/4885BRD7 1050/4885POLB 149/4885

“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.