SCHEMBL7653548

SCHEMBL7653548

O=C(O)c1c(C(F)(F)C(F)(F)C(F)(F)F)ccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 2/20 0.47
GLA P06280 2/20 0.47
HPGD P15428 2/20 0.47
KMT2A Q03164 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
KCNJ11 Q14654 11/20 0.45
ABCC9 O60706 6/20 0.43
ABCC8 Q09428 6/20 0.43
KCNJ8 Q15842 6/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
ATM Q13315 1/20 0.43
METAP2 P50579 2/20 0.41
METAP1 P53582 1/20 0.41
WDR5 P61964 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
SCHEMBL7650892 0.95 KDM4E (0.46) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL7655987 0.94 KDM4E (0.45) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL7653270 0.94 KDM4E (0.45) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL3370877 0.83 HPGD (0.53) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL3371673 0.78 HSD17B10 (0.55) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL18243167 0.77 ALDH1A1 (0.44) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL974719 0.77 HSD17B10 (0.53) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL3369494 0.77 HSD17B10 (0.53) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL3369592 0.77 HPGD (0.53) KDM4EMEN1ALDH1A1GLAHPGD
SCHEMBL8878613 0.76 HSD17B10 (0.52) KDM4EMEN1ALDH1A1GLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6383274-B1 Ink jet ink compositions and printing processes XEROX CORPORATION 2002-05-07 US claimed
US-6383274-B1 Ink jet ink compositions and printing processes XEROX CORPORATION 2002-05-07 US disclosed