SCHEMBL23099869

SCHEMBL23099869

Cc1cnc(C(F)(F)F)c(Cl)c1C

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.34
▸ CCR5 P51681 1/20 0.34
▸ CCR8 P51685 1/20 0.34
▸ NOTUM Q6P988 1/20 0.33
▸ ATF1 P18846 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ AXL P30530 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ GLP1R P43220 1/20 0.31
▸ KDM5B Q9UGL1 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
SCHEMBL20118471 0.83 PLAU (0.42) NOTUMATF1NFKB1GLP1RKDM5B
SCHEMBL20457090 0.81 CCR1 (0.35) CCR1CCR5CCR8AXLPRKCI
SCHEMBL24843396 0.80 KDM4E (0.33) ATF1NFKB1GLP1R
SCHEMBL23099873 0.77 CCR1 (0.35) CCR1CCR5CCR8KDM5B
SCHEMBL25584916 0.72 HTT (0.42) ATF1NFKB1GLP1R
SCHEMBL21279619 0.72 KDM5B (0.36) CCR1CCR5CCR8KDM5B
SCHEMBL2146161 0.71 ATF1 (0.37) NOTUMATF1NFKB1GLP1R
SCHEMBL23508729 0.71 SMN1; SMN2 (0.38) CCR1CCR5CCR8NOTUM
SCHEMBL12203584 0.71 NFKB1 (0.44) ATF1NFKB1GLP1R
SCHEMBL8356225 0.71 ALDH1A1 (0.39) ATF1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303495-A9 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI JEYOU PHARMACEUTICAL CO., LTD. (CN) 2023-09-28 — — US disclosed
US-20230026907-A1 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF ORION CORP (FI) 2023-01-26 — — US disclosed
WO-2021047622-A1 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF 上海济煜医药科技有限公司 2021-03-18 — — 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-20230026907-A1 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF SCN11A, HCN4, CACNA1F CCR1 3678/4885CCR5 3283/4885CCR8 3353/4885
US-20230303495-A9 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF SCN11A, HCN4, CACNA1F CCR1 3678/4885CCR5 3283/4885CCR8 3353/4885

“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.

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