SCHEMBL28048608

SCHEMBL28048608

CCC(=O)c1cccc(OC(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
ATM Q13315 1/20 0.51
MEN1 O00255 4/20 0.50
RAB9A P51151 4/20 0.50
NPSR1 Q6W5P4 3/20 0.50
MAPT P10636 3/20 0.50
LMNA P02545 2/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
KDM4E B2RXH2 2/20 0.48
GAA P10253 1/20 0.48
NPC1 O15118 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
POLB P06746 2/20 0.46
HTT P42858 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL19707956 0.87 PDE4A (0.51) KMT2AATMMEN1RAB9ANPSR1
SCHEMBL1416792 0.85 KMT2A (0.55) KMT2AMEN1RAB9ALMNASMN1; SMN2
SCHEMBL14518781 0.84 PDE4D (0.52) KMT2AATMMEN1RAB9ANPSR1
SCHEMBL29440418 0.83 GSK3B (0.53) KMT2AATMMEN1RAB9ANPSR1
SCHEMBL1542192 0.83 GSK3B (0.53) KMT2AATMMEN1RAB9ANPSR1
SCHEMBL13780117 0.82 KAT6A (0.52) MRGPRX4
SCHEMBL2277217 0.81 KMT2A (0.54) KMT2AATMMEN1RAB9ANPSR1
SCHEMBL733307 0.81 CES2 (0.67) KMT2AMEN1RAB9AMAPTLMNA
SCHEMBL25736079 0.81 ERCC5 (0.49) KMT2ARAB9AMAPTSMN1; SMN2GAA
SCHEMBL10883891 0.81 HDAC3 (0.60) KMT2AATMMEN1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104411709-B Can be used as imidazo [2, the 1] thiazole-3-ketone derivatives of the diagnostic agent of Alzheimer 霍夫曼-拉罗奇有限公司 2016-08-24 CN disclosed
CN-102844318-B Be used for the treatment of the compound of respiratory syncytial virus infection BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2016-04-13 CN disclosed
CN-103906746-B (4-phenylimidazol-2-yl) ethylamine derivatives as sodium channel modulators PFIZER LTD. (GB) 2015-12-09 CN disclosed