SCHEMBL27692103

SCHEMBL27692103

COc1ccc(-c2cccc(Nc3ncccn3)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 4/20 0.69
▸ PIK3CG P48736 4/20 0.61
▸ PIK3CA P42336 3/20 0.61
▸ PIK3CB P42338 3/20 0.61
▸ CDK5 Q00535 2/20 0.57
▸ EGFR P00533 1/20 0.52
▸ ACHE P22303 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ CDK5R1 Q15078 1/20 0.51
▸ ABL1 P00519 1/20 0.50
▸ ABCB1 P08183 1/20 0.50
▸ BCR P11274 1/20 0.50
▸ ACP1 P24666 1/20 0.49
▸ CLK4 Q9HAZ1 1/20 0.49
▸ RAF1 P04049 1/20 0.48
▸ BRAF P15056 1/20 0.48
▸ AKR1C3 P42330 1/20 0.48

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
SCHEMBL12269586 0.85 SYK (0.62) SYKPIK3CGPIK3CAPIK3CBCDK5
SCHEMBL19347495 0.82 SYK (1.00) SYK
SCHEMBL2284267 0.82 EGFR (0.72) SYKPIK3CGPIK3CAPIK3CBCDK5
SCHEMBL31316191 0.81 CNR1 (0.55) SYKPIK3CGPIK3CAPIK3CBCDK5
SCHEMBL22347706 0.81 CNR1 (0.55) SYKPIK3CGPIK3CAPIK3CBCDK5
SCHEMBL1121223 0.80 RAB9A (0.67) SYKPIK3CGPIK3CAPIK3CBCDK5
SCHEMBL28762614 0.80 SYK (0.67) SYKPIK3CGMEN1KMT2ARAF1
SCHEMBL5706320 0.79 SYK (0.53) SYKPIK3CGPIK3CAPIK3CBCDK5
SCHEMBL13924556 0.79 SYK (0.69) SYKPIK3CGPIK3CAPIK3CBCDK5
SCHEMBL13605438 0.78 PIK3CG (0.51) SYKPIK3CGPIK3CAPIK3CBCDK5

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
CN-85103378-A Process for preparing a group of novel compounds, formulations containing these compounds and their use in therapy — 1986-07-09 — — CN claimed
CN-85103378-A Process for preparing a group of novel compounds, formulations containing these compounds and their use in therapy — 1986-07-09 — — CN disclosed
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