SCHEMBL27894380

SCHEMBL27894380

CCOC(=O)c1ccc(N2CCN(CCOC=O)CC2)c(N)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 1/20 0.64
▸ SIRT2 Q8IXJ6 5/20 0.53
▸ SIRT1 Q96EB6 5/20 0.53
▸ SIRT3 Q9NTG7 5/20 0.53
▸ NPC1 O15118 3/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ PTGER4 P35408 3/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.42
▸ P2RY12 Q9H244 1/20 0.41
▸ SRD5A1 P18405 1/20 0.41
▸ SRD5A2 P31213 1/20 0.41
▸ ADORA2B P29275 1/20 0.41
▸ HTR4 Q13639 1/20 0.41

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
Ethoxycarbonyl Group SCHEMBL27894381 0.82 PRMT1 (0.57) PRMT1SIRT2SIRT1SIRT3NPC1
SCHEMBL27319007 0.81 PTGER4 (0.44) PRMT1PTGER4HRH3HTR4
SCHEMBL14804765 0.80 KDM4E (0.71) PRMT1SIRT2SIRT1SIRT3NPC1
SCHEMBL3436249 0.79 PRMT1 (0.68) PRMT1SIRT2SIRT1SIRT3NPC1
SCHEMBL10049116 0.79 KDM4E (0.73) PRMT1SIRT2SIRT1SIRT3NPC1
SCHEMBL24478835 0.78 PRMT1 (1.00) PRMT1SIRT2SIRT1SIRT3NPC1
SCHEMBL31616016 0.71 PRMT1 (0.57) PRMT1SIRT2SIRT1SIRT3NPC1
SCHEMBL27911632 0.70 KCNJ1 (0.45) NPC1KDM4ERAB9AALDH1A1MAPT
SCHEMBL28290347 0.70 HRH3 (0.46) PRMT1KDM4ESMN1; SMN2NPSR1ALDH1A1
SCHEMBL27791208 0.69 KDM4E (0.68) PRMT1NPC1KDM4ERAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105753858-B Heterocyclic compound and p27Kip1Decomposing inhibitor ASKA制药株式会社 2019-04-30 — — CN disclosed
CN-105753858-A Heterocyclic compound and p27Kip1 degradation inhibitor ASKA制药株式会社 2016-07-13 — — CN disclosed
CN-102985405-B Heterocyclic compounds and p27Kip1Decomposition inhibitor ASKA制药株式会社 2016-07-06 — — CN disclosed
CN-102985405-A Heterocyclic compounds and p27Kip1Decomposition inhibitor ASKA PHARM CO LTD 2013-03-20 — — CN disclosed
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