SCHEMBL28188380

SCHEMBL28188380

NC1C(c2ccccc2)CCCN1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ SLC18A3 Q16572 1/20 0.43
▸ DPP4 P27487 1/20 0.43
▸ DPP8 Q6V1X1 1/20 0.43
▸ DPP7 Q9UHL4 1/20 0.43
▸ UTS2R Q9UKP6 4/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ HSP90AB1 P08238 1/20 0.41
▸ KDM1A O60341 2/20 0.41
▸ RCOR1 Q9UKL0 1/20 0.41
▸ SLC6A2 P23975 2/20 0.40
▸ SLC6A4 P31645 2/20 0.40
▸ SLC6A3 Q01959 2/20 0.40
▸ MAOA P21397 2/20 0.40
▸ MAOB P27338 2/20 0.40

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
SCHEMBL28001859 0.83 HRH3 (0.48) KDM1AMAOA
SCHEMBL4392356 0.81 UTS2R (0.49) RIPK1UTS2RCYP2D6
SCHEMBL23123430 0.81 RIPK1 (0.50) RIPK1UTS2R
SCHEMBL5747606 0.77 RIPK1 (0.50) RIPK1ALDH1A1SMN1; SMN2DPP4DPP8
SCHEMBL5746647 0.77 RIPK1 (0.50) RIPK1ALDH1A1SMN1; SMN2DPP4DPP8
SCHEMBL6310814 0.77 RIPK1 (0.50) RIPK1ALDH1A1SMN1; SMN2DPP4DPP8
SCHEMBL5746649 0.77 RIPK1 (0.50) RIPK1ALDH1A1SMN1; SMN2DPP4DPP8
SCHEMBL1847627 0.76 RIPK1 (0.69) RIPK1HSP90AA1HSP90AB1
SCHEMBL1853141 0.76 RIPK1 (0.69) RIPK1HSP90AA1HSP90AB1
SCHEMBL17558248 0.76 RIPK1 (0.69) RIPK1HSP90AA1HSP90AB1

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-105102456-B Azaquinazoline inhibitors of atypical protein kinase C 癌症研究技术有限公司 2017-11-14 — — CN disclosed
CN-105102456-A Azaquinazoline inhibitors of atypical protein kinase C IGNYTA INC 2015-11-25 — — CN disclosed
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