SCHEMBL20577339

SCHEMBL20577339

Cc1cccc(C)c1-n1nc2c(c1Br)CN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 9/20 0.64
F12 P00748 3/20 0.47
PARP1 P09874 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
PARP2 Q9UGN5 1/20 0.41
MAPT P10636 2/20 0.41
ESR2 Q92731 1/20 0.41
NR1H2 P55055 1/20 0.40
PDE10A Q9Y233 1/20 0.39

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
SCHEMBL21446959 0.88 C5AR1 (0.60) C5AR1F12PARP1TNKS2PARP2
SCHEMBL20577486 0.87 C5AR1 (0.70) C5AR1
SCHEMBL31345653 0.87 C5AR1 (0.70) C5AR1
SCHEMBL21725722 0.87 C5AR1 (0.67) C5AR1F12PARP1TNKS2PARP2
SCHEMBL26077543 0.87 C5AR1 (0.64) C5AR1F12PARP1TNKS2PARP2
SCHEMBL28376584 0.84 C5AR1 (0.46) C5AR1
SCHEMBL20577618 0.82 C5AR1 (0.48) C5AR1F12MAPTESR2NR1H2
SCHEMBL21074133 0.81 C5AR1 (0.75) C5AR1
SCHEMBL21139178 0.81 C5AR1 (0.79) C5AR1
SCHEMBL20577551 0.80 C5AR1 (0.59) C5AR1F12

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 16 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-11773091-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2023-10-03 US disclosed
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
US-20230151002-A1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX, INC. 2023-05-18 US disclosed
US-20230151002-A1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX, INC. 2023-05-18 US disclosed
CN-110997674-B 6-5 fused rings as C5a inhibitors 凯莫森特里克斯股份有限公司 2022-12-20 CN disclosed
EP-3630775-B1 6-5 FUSED RINGS AS C5a INHIBITORS CHEMOCENTRYX INC (US) 2022-12-14 EP 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 C5AR1 1/4885F12 27/4885PARP1 2518/4885
US-20230151002-A1 6-5 FUSED RINGS AS C5a INHIBITORS C5AR1, C5AR2, C3AR1 C5AR1 1/4885F12 27/4885PARP1 2518/4885
US-11773091-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 C5AR1 1/4885F12 27/4885PARP1 2518/4885
US-11384079-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 C5AR1 1/4885F12 27/4885PARP1 2518/4885
US-10562896-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 C5AR1 1/4885F12 27/4885PARP1 2518/4885
US-20180370967-A1 6-5 FUSED RINGS AS C5a INHIBITORS C5AR1, C5AR2, C3AR1 C5AR1 1/4885F12 27/4885PARP1 2518/4885

“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.