SCHEMBL20577611

SCHEMBL20577611

Cc1cc(F)c(B2OC(C)(C)C(C)(C)O2)c2cn[nH]c12

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.30
GSK3A P49840 1/20 0.30
GSK3B P49841 1/20 0.30

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
SCHEMBL21725712 0.76 NR3C1 (0.34)
SCHEMBL29795157 0.75 IDO1 (0.38)
SCHEMBL21542750 0.74 IDO1 (0.37) TRPA1
SCHEMBL3496478 0.72 MAPT (0.35) GSK3AGSK3B
SCHEMBL20085466 0.72 TRPA1 (0.40) TRPA1GSK3AGSK3B
SCHEMBL31620771 0.72 TRPA1 (0.40) TRPA1GSK3AGSK3B
SCHEMBL24373906 0.71 MAPT (0.34) TRPA1
SCHEMBL29479125 0.71 MAPT (0.34) TRPA1
SCHEMBL3497188 0.71 LPL (0.34)
SCHEMBL3498002 0.71 EGFR (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773091-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2023-10-03 US disclosed
US-20230151002-A1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX, INC. 2023-05-18 US disclosed
EP-3630775-B1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX INC (US) 2022-12-14 EP disclosed
US-11384079-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2022-07-12 US disclosed
US-20200347049-A1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX, INC. 2020-11-05 US disclosed
CN-110997674-A 6-5 fused rings as C5a inhibitors 凯莫森特里克斯股份有限公司 2020-04-10 CN disclosed
EP-3630775-A1 6-5 FUSED RINGS AS C5a INHIBITORS ChemoCentryx, Inc. (US) 2020-04-08 EP disclosed
US-10562896-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2020-02-18 US disclosed
US-20180370967-A1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX, INC. 2018-12-27 US disclosed
WO-2018222598-A1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX, INC. (US) 2018-12-06 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 (6 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-20200347049-A1 6-5 FUSED RINGS AS C5a INHIBITORS C5AR1, C5AR2, C3AR1 TRPA1 1717/4885GSK3A 4457/4885GSK3B 4276/4885
US-20230151002-A1 6-5 FUSED RINGS AS C5a INHIBITORS C5AR1, C5AR2, C3AR1 TRPA1 1717/4885GSK3A 4457/4885GSK3B 4276/4885
US-11773091-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 TRPA1 1717/4885GSK3A 4457/4885GSK3B 4276/4885
US-11384079-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 TRPA1 1717/4885GSK3A 4457/4885GSK3B 4276/4885
US-10562896-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 TRPA1 1717/4885GSK3A 4457/4885GSK3B 4276/4885
US-20180370967-A1 6-5 FUSED RINGS AS C5a INHIBITORS C5AR1, C5AR2, C3AR1 TRPA1 1717/4885GSK3A 4457/4885GSK3B 4276/4885

“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.