SCHEMBL28165403

SCHEMBL28165403

Cn1c(C=O)c(Cl)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 7/20 0.54
▸ TDP1 Q9NUW8 6/20 0.54
▸ ATM Q13315 4/20 0.54
▸ GPR3 P46089 1/20 0.48
▸ NPSR1 Q6W5P4 5/20 0.47
▸ MAPT P10636 5/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ XBP1 P17861 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ PAX8 Q06710 1/20 0.47
▸ TLR9 Q9NR96 1/20 0.47
▸ HTT P42858 5/20 0.47
▸ NOD2 Q9HC29 1/20 0.47
▸ IMPDH2 P12268 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ NQO2 P16083 1/20 0.44
▸ CYP1A2 P05177 2/20 0.44

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
SCHEMBL1092376 0.79 L3MBTL1 (0.55) L3MBTL1TDP1ATMGPR3NPSR1
SCHEMBL28236134 0.78 L3MBTL1 (0.54) L3MBTL1TDP1ATMGPR3NPSR1
SCHEMBL26631768 0.78 TDP1 (0.54) L3MBTL1TDP1ATMGPR3NPSR1
SCHEMBL14222653 0.78 L3MBTL1 (0.54) L3MBTL1TDP1ATMGPR3NPSR1
SCHEMBL28444190 0.77 LMNA (0.40) L3MBTL1TDP1ATMNPSR1MAPT
SCHEMBL28438215 0.77 POLB (0.43) L3MBTL1TDP1ATMNPSR1MAPT
SCHEMBL28165051 0.77 ALDH1A1 (0.51) L3MBTL1TDP1NPSR1MAPTSMN1; SMN2
SCHEMBL29957670 0.76 POLB (0.58) L3MBTL1TDP1NPSR1MAPTALDH1A1
SCHEMBL4200546 0.76 BRPF1 (0.39) L3MBTL1TDP1ATMNPSR1MAPT
SCHEMBL28165405 0.75 KMT2A (0.53) L3MBTL1TDP1ATMMAPTALDH1A1

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
CN-106928121-B High-efficiency preparation method of 3-substituted-benzo five-membered heterocycle-2-carbonyl compound 暨南大学 2020-05-12 — — CN disclosed
CN-107635961-A Indoles analog and its application method as 5 oxo ETE receptor antagonists 皇家学习促进学会/麦吉尔大学 2018-01-26 — — CN disclosed
CN-106928121-A The high efficiency preparation method of 3- substitution-benzo five-membered heterocycle -2- carbonyls 暨南大学 2017-07-07 — — CN disclosed
Send feedback