SCHEMBL17129834

SCHEMBL17129834

Cc1ccnc(Nc2ccc(OCCN3CCOCC3)c(-c3cnc(N4CCNC(=O)C45CC5)o3)c2)n1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 6/20 0.48
▸ HTR2A P28223 9/20 0.38
▸ HTR2C P28335 7/20 0.38
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ JAK3 P52333 1/20 0.38
▸ ABL1 P00519 1/20 0.37
▸ BCR P11274 1/20 0.37
▸ PRKDC P78527 1/20 0.37
▸ GSK3A P49840 3/20 0.36
▸ MAPK14 Q16539 3/20 0.36
▸ GRM4 Q14833 1/20 0.36

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
SCHEMBL17113597 0.90 SYK (0.47) SYKHTR2AHTR2CABL1GSK3A
SCHEMBL17129790 0.87 SYK (0.42) SYKHTR2AHTR2CABL1BCR
SCHEMBL17113604 0.83 SYK (0.55) SYKJAK2JAK1TYK2JAK3
SCHEMBL17113328 0.80 SYK (0.54) SYKJAK2JAK1TYK2JAK3
SCHEMBL17113385 0.78 SYK (0.75) SYKJAK2JAK1TYK2JAK3
SCHEMBL17129840 0.77 SYK (0.62) SYKJAK2JAK1TYK2JAK3
SCHEMBL17113602 0.75 SYK (0.70) SYKJAK2JAK1TYK2JAK3
SCHEMBL17113444 0.75 SYK (0.70) SYKJAK2JAK1TYK2JAK3
SCHEMBL17113599 0.75 SYK (0.54) SYKJAK2JAK1TYK2JAK3
SCHEMBL18627915 0.72 SYK (0.45) SYKJAK2JAK1TYK2JAK3

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-20180179195-A1 DIAZASPIROALKANEONE-SUBSTITUTED OXAZOLE DERIVATIVES AS SPLEEN TYROSINE KINASE INHIBITORS AB SCIENCE (FR) 2018-06-28 — — US disclosed
WO-2015144614-A1 DIAZASPIROALKANEONE-SUBSTITUTED OXAZOLE DERIVATIVES AS SPLEEN TYROSINE KINASE INHIBITORS AB SCIENCE (FR) 2015-10-01 — — 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 (1 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-20180179195-A1 DIAZASPIROALKANEONE-SUBSTITUTED OXAZOLE DERIVATIVES AS SPLEEN TYROSINE KINASE INHIBITORS SYK, ZAP70, LCK SYK 1/4885HTR2A 4092/4885HTR2C 3765/4885

“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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