SCHEMBL28280447

SCHEMBL28280447

Clc1cc2ccc(-c3ccccc3)cc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.49
NPC1 O15118 4/20 0.47
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 3/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
GAA P10253 1/20 0.42
CDK4 P11802 2/20 0.42
CCND1 P24385 2/20 0.42
CNR1 P21554 1/20 0.42
CYP1A2 P05177 2/20 0.41
ESR2 Q92731 3/20 0.41
RAB9A P51151 3/20 0.41
ESR1 P03372 2/20 0.41
TNKS2 Q9H2K2 1/20 0.41
CASP3 P42574 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
ALDH1A1 P00352 2/20 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
SCHEMBL5130538 0.78 NPC1 (0.68) FGFR1NPC1KDM4EMEN1MAPT
SCHEMBL13541757 0.77 TNKS2 (0.49) FGFR1NPC1KDM4EMEN1MAPT
SCHEMBL27290615 0.77 ESR2 (0.50) FGFR1NPC1KDM4EMEN1MAPT
SCHEMBL28281112 0.77 FGFR1 (0.49) FGFR1NPC1KDM4EMEN1MAPT
SCHEMBL28159595 0.77 FGFR1 (0.49) FGFR1NPC1KDM4EMEN1MAPT
SCHEMBL980499 0.74 AOC3 (0.54) NPC1KDM4EMEN1MAPTKMT2A
SCHEMBL27805572 0.73 CA12 (0.59) FGFR1NPC1KDM4EMEN1MAPT
SCHEMBL24446576 0.73 FGFR1 (0.45) FGFR1NPC1KDM4EMEN1MAPT
Phenol SCHEMBL3166162 0.73 DAO (0.51) NPC1KDM4EMEN1MAPTKMT2A
SCHEMBL3389181 0.73 HSD17B10 (0.66) KDM4EMEN1MAPTKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109503596-A The method of level-one amine guiding building 2- chloro-6-phenyl indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-03-22 CN claimed
CN-109608467-A The method of level-one amine guiding building 8- chloro-6-phenyl indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-04-12 CN disclosed
CN-109503596-A The method of level-one amine guiding building 2- chloro-6-phenyl indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-03-22 CN disclosed
CN-109503596-A The method of level-one amine guiding building 2- chloro-6-phenyl indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-03-22 CN disclosed
CN-109503596-A The method of level-one amine guiding building 2- chloro-6-phenyl indoles simultaneously [1,2-a] quinoxaline 桂林理工大学 2019-03-22 CN disclosed