SCHEMBL28979019

SCHEMBL28979019

CC(C)c1nc2c(Cl)nc(Cl)nc2n1C

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ CDK1 P06493 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ PAX8 Q06710 1/20 0.31
▸ YTHDC1 Q96MU7 1/20 0.30

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
SCHEMBL31625100 0.76 KDM4E (0.38) CDK1KDM4EJAK2ALDH1A1LMNA
SCHEMBL15600397 0.76 KDM4E (0.38) CDK1KDM4EJAK2ALDH1A1LMNA
SCHEMBL38656749 0.73 CDK1 (0.33) CDK1KDM4EJAK2ALDH1A1LMNA
SCHEMBL16499765 0.69 CYP1A2 (0.33) CDK1KDM4EJAK2ALDH1A1LMNA
SCHEMBL14685223 0.67 HTT (0.50) KMT2ARXFP1ALDH1A1LMNAHTT
SCHEMBL9937313 0.67 YTHDC1 (0.44) YTHDC1
SCHEMBL6901185 0.67 DAPK1 (0.35) CDK1JAK2
SCHEMBL25280574 0.66 PIK3CD (0.34) —
SCHEMBL22810868 0.65 KMT2A (0.44) KMT2ARXFP1KDM4EJAK2ALDH1A1
SCHEMBL539356 0.62 CDK2 (0.56) CDK1KDM4E

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-115710199-B Photooxidation reduction catalytic process 深圳湾实验室坪山生物医药研发转化中心 2024-06-28 — — CN disclosed
CN-115710199-A Photo-oxidation-reduction catalysis method 深圳湾实验室坪山生物医药研发转化中心 2023-02-24 — — CN disclosed
CN-113387837-B Photo-oxidation-reduction catalysis method 深圳湾实验室坪山生物医药研发转化中心 2023-02-21 — — CN disclosed
CN-113387837-A Photo-oxidation-reduction catalysis method 深圳湾实验室坪山生物医药研发转化中心 2021-09-14 — — CN disclosed
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