SCHEMBL20569630

SCHEMBL20569630

O=C(O)c1[nH]c2c(Br)csc2c1-c1cc(Cl)cc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 9/20 0.56
MAP2 P11137 1/20 0.36
RXRA P19793 2/20 0.35
RXRB P28702 2/20 0.35
RHEB Q15382 1/20 0.35
TPMT P51580 1/20 0.33
ALAD P13716 1/20 0.32
FBP1 P09467 1/20 0.32
RPA1 P27694 1/20 0.31
MCL1 Q07820 1/20 0.31

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
SCHEMBL20568821 0.82 GPR35 (0.43) GPR35MAP2RXRARXRBRHEB
SCHEMBL23327553 0.81 GPR35 (0.42) GPR35MAP2RXRARXRBRHEB
SCHEMBL23327639 0.81 GPR35 (0.42) GPR35MCL1
SCHEMBL20568383 0.81 GPR35 (0.45) GPR35
SCHEMBL23327722 0.80 GPR35 (0.41) GPR35MAP2RXRARXRBRHEB
SCHEMBL23327571 0.80 GPR35 (0.61) GPR35MAP2RXRARXRBRHEB
SCHEMBL23327816 0.80 GPR35 (0.41) GPR35MAP2RXRARXRBRHEB
SCHEMBL20568486 0.79 GPR35 (0.55) GPR35FBP1RPA1MCL1
SCHEMBL23351411 0.78 GPR35 (0.50) GPR35FBP1RPA1MCL1
SCHEMBL23327350 0.77 GPR35 (0.39) GPR35MAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210137886-A1 INHIBITORS OF METALLO-BETA-LACTAMASES OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2021-05-13 US claimed
US-20210137886-A1 INHIBITORS OF METALLO-BETA-LACTAMASES OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2021-05-13 US disclosed
US-20210137886-A1 INHIBITORS OF METALLO-BETA-LACTAMASES OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2021-05-13 US disclosed
EP-3630777-A1 INHIBITORS OF METALLO-BETA-LACTAMASES Oxford University Innovation Limited (GB) 2020-04-08 EP disclosed
WO-2018215800-A1 INHIBITORS OF METALLO-BETA-LACTAMASES OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2018-11-29 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-20210137886-A1 INHIBITORS OF METALLO-BETA-LACTAMASES MGAM, GAA, LCT GPR35 4727/4885MAP2 2432/4885RXRA 4626/4885

“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.