SCHEMBL27871292

SCHEMBL27871292

CSn1cnc2c(NCCC(C)C)ncnc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ CDK1 P06493 9/20 0.48
▸ CCNB2 O95067 8/20 0.48
▸ CCNB1 P14635 8/20 0.48
▸ CCNB3 Q8WWL7 8/20 0.48
▸ TSHR P16473 1/20 0.45
▸ DOT1L Q8TEK3 1/20 0.43
▸ TMIGD3 P0DMS9 3/20 0.43
▸ ADORA2A P29274 3/20 0.43
▸ ADORA1 P30542 3/20 0.43
▸ ADORA2B P29275 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CDK2 P24941 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38

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
SCHEMBL7561785 0.87 CCNB2 (0.49) RAB9AKMT2ACDK1CCNB2CCNB1
SCHEMBL28061333 0.78 YTHDC1 (0.50) RAB9AKMT2ACDK1CCNB2CCNB1
SCHEMBL26255179 0.76 YTHDC1 (0.63) RAB9AKMT2ACDK1CCNB2CCNB1
Hydrochloric Acid SCHEMBL27460068 0.74 YTHDC1 (0.55) RAB9AKMT2ACDK1CCNB2CCNB1
SCHEMBL642276 0.70 CDK1 (0.46) RAB9AKMT2ACDK1CCNB2CCNB1
SCHEMBL640682 0.69 CDK1 (0.51) CDK1CCNB2CCNB1CCNB3TMIGD3
SCHEMBL6135888 0.69 CDK1 (0.57) RAB9AKMT2ACDK1CCNB2CCNB1
SCHEMBL24920121 0.68 SLC29A1 (0.75) TSHRADORA2AADORA1
SCHEMBL547463 0.68 SLC29A1 (0.75) TSHRADORA2AADORA1
SCHEMBL547462 0.68 SLC29A1 (0.75) TSHRADORA2AADORA1

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-106459133-A Protecting groups for z nucleotide and methods thereof 安捷伦科技有限公司 2017-02-22 — — CN disclosed
CN-102481378-A Hpv particles and uses thereof INST NAT SANTE RECH MED 2012-05-30 — — CN disclosed
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