SCHEMBL29049893

SCHEMBL29049893

CC1=Cc2cc(-c3ccccc3)ccc2C1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HSP90AA1 P07900 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ALOX5 P09917 1/20 0.34
KDM1A O60341 2/20 0.34
KDM1B Q8NB78 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33

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
SCHEMBL27479178 0.81 MAOA (0.34) MAOAGAAMEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL4092756 0.79 MAOA (0.33) MAOAGAAMEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL4094393 0.79 MAOA (0.33) MAOAGAAMEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL4059545 0.79 MAOA (0.33) MAOAGAAMEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL27505811 0.78 MAOA (0.32) MAOAGAAMEN1KMT2AKDM4E
Hydrochloric Acid SCHEMBL18112870 0.78 ESR1 (0.33) MAOAGAAMEN1KMT2AKDM4E
SCHEMBL4092757 0.77 KDM1A (0.34) MAOAGAAALOX5KDM1AKDM1B
SCHEMBL4059549 0.77 ESR2 (0.32) MAOAGAAALOX5KDM1AKDM1B
Hydrochloric Acid SCHEMBL6910738 0.76 MAOA (0.31) MAOAGAAMEN1KMT2AKDM4E
SCHEMBL2320957 0.74 GAA (0.32) MAOAGAAKDM1AKDM1BL3MBTL1

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-116410237-A Synthesis method of non-bridged symmetrical metallocene catalyst, product and application thereof 中国石油天然气股份有限公司 2023-07-11 CN disclosed