SCHEMBL29134576

SCHEMBL29134576

Cc1cc2cc(C(=O)O)ccc2n1-c1ncccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.47
POLB P06746 3/20 0.46
HTT P42858 1/20 0.43
MYC P01106 5/20 0.41
ALOX15 P16050 2/20 0.41
PTPN7 P35236 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ESR1 P03372 1/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSPA1A P0DMV8 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
NR4A1 P22736 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL4405521 0.81 HSD17B10 (0.61) HSD17B10POLBHTTMYCALOX15
SCHEMBL28484200 0.79 ALDH1A1 (0.44) L3MBTL1KDM4EALDH1A1MAPTTDP1
SCHEMBL28486433 0.76 PDE2A (0.36) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL28492642 0.75 SLC6A2 (0.45) KMT2AKDM4EALDH1A1MAPT
SCHEMBL12089746 0.74 NOTUM (0.55) HSD17B10POLBHTTMYCALOX15
SCHEMBL2610310 0.74 POLB (0.48) HSD17B10POLBKDM4EALDH1A1RAPGEF4
SCHEMBL3987986 0.73 KDM4E (0.55) HSD17B10MYCALOX15PTPN7MEN1
SCHEMBL28025054 0.73 MYC (0.45) HSD17B10POLBHTTMYCALOX15
SCHEMBL30622485 0.73 KDM4E (0.55) HSD17B10MYCALOX15PTPN7MEN1
SCHEMBL24931088 0.72 KDM4E (0.61) HSD17B10POLBKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117343044-A Synthesis method of 2-methyl-1- (pyridine-2-yl) indole compound 太原理工大学 2024-01-05 CN disclosed