SCHEMBL5819902

SCHEMBL5819902

COCCN1CCCC(n2nc(I)c3c(N)nccc32)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 5/20 0.40
▸ JAK2 O60674 4/20 0.40
▸ JAK1 P23458 2/20 0.38
▸ TYK2 P29597 2/20 0.38
▸ BTK Q06187 2/20 0.38
▸ EGFR P00533 1/20 0.38
▸ RET P07949 1/20 0.37
▸ PIK3CD O00329 7/20 0.36
▸ PIK3R2 O00459 7/20 0.36
▸ PIK3CA P42336 7/20 0.36
▸ PIK3CB P42338 7/20 0.36
▸ PIK3CG P48736 7/20 0.36
▸ PIK3R5 Q8WYR1 7/20 0.36
▸ PIK3R3 Q92569 7/20 0.36
▸ ATR Q13535 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ OGFRL1 Q5TC84 1/20 0.36
▸ CCNT1 O60563 1/20 0.35
▸ CDK9 P50750 1/20 0.35
▸ GHSR Q92847 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
SCHEMBL5810315 0.88 JAK2 (0.39) JAK3JAK2JAK1EGFRRET
SCHEMBL5812791 0.83 EGFR (0.42) JAK3JAK2BTKEGFRRET
SCHEMBL4818423 0.83 JAK2 (0.56) JAK3JAK2JAK1TYK2BTK
SCHEMBL4818418 0.83 JAK2 (0.56) JAK3JAK2JAK1TYK2BTK
SCHEMBL6246222 0.81 KAT2B (0.36) JAK3JAK2JAK1TYK2BTK
Acetic Acid SCHEMBL4819303 0.78 JAK3 (0.58) JAK3JAK2JAK1TYK2BTK
Acetic Acid SCHEMBL4819297 0.78 JAK3 (0.58) JAK3JAK2JAK1TYK2BTK
SCHEMBL4818634 0.76 JAK2 (0.54) JAK3JAK2JAK1TYK2BTK
SCHEMBL5818829 0.76 GAA (0.47) JAK3JAK2JAK1BTKEGFR
SCHEMBL5814297 0.75 RET (0.39) JAK3JAK2BTKEGFRRET

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
EP-1385524-A4 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH & CO KG (DE) 2006-02-01 — — EP disclosed
EP-1385524-A1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS Abbott GmbH & Co. KG (DE) 2004-02-04 — — EP disclosed
WO-2002080926-A1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH & CO. KG (DE) 2002-10-17 — — WO disclosed
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