SCHEMBL21726013

SCHEMBL21726013

CC(C)c1ncc(Cl)c2[nH]ccc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.38
PRKCI P41743 2/20 0.38
AHR P35869 1/20 0.35
BTK Q06187 1/20 0.34
DYRK1A Q13627 1/20 0.33
RHEB Q15382 1/20 0.31
CCR8 P51685 1/20 0.31
CCNK O75909 1/20 0.30
CDK12 Q9NYV4 1/20 0.30
JAK3 P52333 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
SCHEMBL8737516 0.82 BTK (0.36) AXLPRKCIBTKJAK3
SCHEMBL6127940 0.81 AXL (0.42) AXLPRKCIBTKCCR8CCNK
SCHEMBL18819909 0.77 BTK (0.33) BTK
SCHEMBL26145364 0.77 AXL (0.44) AXLPRKCIAHRDYRK1ARHEB
SCHEMBL12491288 0.76 PRKCI (0.42) AXLPRKCIAHRDYRK1ARHEB
SCHEMBL8736950 0.75 TAAR1 (0.36) AXLPRKCIBTKCCNKCDK12
SCHEMBL8735125 0.74 PRKCI (0.42) AXLPRKCIBTKCCR8CCNK
SCHEMBL20577529 0.73 PRKCI (0.40) AXLPRKCIAHRDYRK1ARHEB
SCHEMBL31000812 0.73 PRKCI (0.40) AXLPRKCIAHRDYRK1ARHEB
SCHEMBL18101002 0.72 ALDH1A1 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-10562896-B2 6-5 fused rings as C5a inhibitors CHEMOCENTRYX, INC. (US) 2020-02-18 US 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 (3 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 AXL 530/4885PRKCI 3753/4885AHR 2160/4885
US-11384079-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 AXL 530/4885PRKCI 3753/4885AHR 2160/4885
US-10562896-B2 6-5 fused rings as C5a inhibitors C5AR1, C5AR2, C3AR1 AXL 530/4885PRKCI 3753/4885AHR 2160/4885

“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.