SCHEMBL30804387

SCHEMBL30804387

O=c1[nH]c2ccccc2c(F)c1F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.59
ALDH1A1 P00352 5/20 0.59
PARP1 P09874 5/20 0.59
LMNA P02545 2/20 0.59
GPR3 P46089 2/20 0.59
HSD17B10 Q99714 2/20 0.59
MEN1 O00255 1/20 0.59
TNKS O95271 1/20 0.59
CYP1A2 P05177 1/20 0.59
BLM P54132 1/20 0.59
PMP22 Q01453 1/20 0.59
KMT2A Q03164 1/20 0.59
PARP15 Q460N3 1/20 0.59
TNKS2 Q9H2K2 1/20 0.59
MAPT P10636 2/20 0.53
IDE P14735 1/20 0.53
MPI P34949 1/20 0.53
CACNA1B Q00975 1/20 0.53
APBA1 Q02410 1/20 0.53
GRIN2D O15399 2/20 0.52

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
SCHEMBL1268537 1.00 KDM4E (0.59) KDM4EALDH1A1PARP1LMNAGPR3
Urea SCHEMBL28581689 0.91 KDM4E (0.50) KDM4EALDH1A1PARP1LMNAGPR3
SCHEMBL476707 0.82 KDM4E (0.53) KDM4EALDH1A1PARP1LMNAGPR3
SCHEMBL28614567 0.82 KDM4E (0.57) KDM4EALDH1A1PARP1LMNAGPR3
SCHEMBL17942038 0.82 KDM4E (0.69) KDM4EALDH1A1PARP1LMNAGPR3
SCHEMBL29096075 0.82 KDM4E (0.53) KDM4EALDH1A1PARP1LMNAGPR3
SCHEMBL28619357 0.81 PARP1 (0.41) KDM4EALDH1A1PARP1LMNAGPR3
SCHEMBL29032486 0.81 PARP1 (0.41) KDM4EALDH1A1PARP1LMNAGPR3
SCHEMBL6825380 0.79 MAPT (0.65) KDM4EALDH1A1PARP1LMNAGPR3
SCHEMBL30880427 0.79 KDM4E (0.50) KDM4EALDH1A1PARP1LMNAGPR3

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-117624046-A Synthesis method of ethoxylomefloxacin 江苏吉贝尔药业股份有限公司 2024-03-01 CN disclosed