SCHEMBL19230488

SCHEMBL19230488

Cc1cnccc1C(=O)Nc1cnc(-c2cc(Oc3ccccn3)ccc2OC(F)(F)F)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IL2 P60568 2/20 0.39
▸ LIPE Q05469 1/20 0.37
▸ EGFR P00533 2/20 0.37
▸ FGFR1 P11362 2/20 0.37
▸ KDR P35968 2/20 0.37
▸ CHRM5 P08912 1/20 0.37
▸ NTRK1 P04629 2/20 0.36
▸ ABL1 P00519 3/20 0.36
▸ SCN10A Q9Y5Y9 2/20 0.36
▸ SCN8A Q9UQD0 1/20 0.36
▸ PNLIP P16233 1/20 0.35
▸ S1PR1 P21453 1/20 0.35
▸ S1PR3 Q99500 1/20 0.35
▸ STIM1 Q13586 1/20 0.35
▸ ORAI1 Q96D31 1/20 0.35
▸ SCN9A Q15858 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL13730757 0.94 IL2 (0.38) IL2LIPEEGFRFGFR1KDR
SCHEMBL13838440 0.81 IL2 (0.40) IL2KDRABL1SCN10ASCN8A
SCHEMBL13838351 0.79 STIM1 (0.41) IL2KDRSTIM1ORAI1NPC1
SCHEMBL5550650 0.78 ORAI1 (0.52) IL2STIM1ORAI1NPC1RAB9A
SCHEMBL15395956 0.75 KDM4E (0.47) IL2STIM1ORAI1NPC1RAB9A
SCHEMBL2308590 0.75 IL2 (0.57) IL2STIM1ORAI1NPC1RAB9A
SCHEMBL2847563 0.74 IL2 (0.55) IL2STIM1ORAI1NPC1RAB9A
SCHEMBL13727794 0.74 STIM1 (0.43) IL2NTRK1STIM1ORAI1NPC1
SCHEMBL2305751 0.73 ABL1 (0.50) IL2NTRK1ABL1STIM1ORAI1
SCHEMBL13728621 0.73 ABL1 (0.44) IL2ABL1STIM1ORAI1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10399967-B2 Compounds for inflammation and immune-related uses PRCL Research Inc. (CA) 2019-09-03 — — US disclosed
US-20170231984-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES PRCL Research Inc. (CA) 2017-08-17 — — 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 (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-10399967-B2 Compounds for inflammation and immune-related uses CXCL8, CCR1, CCR8 IL2 13/4885LIPE 567/4885EGFR 1375/4885
US-20170231984-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 IL2 13/4885LIPE 567/4885EGFR 1375/4885

“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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