SCHEMBL9064840

SCHEMBL9064840

O=C(Oc1ccccc1)c1cc(F)c(Cl)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
ALOX15 P16050 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MAPT P10636 5/20 0.46
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
NSD2 O96028 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CHRM1 P11229 1/20 0.45
TBXA2R P21731 1/20 0.45
SLC6A2 P23975 1/20 0.45
PDE4A P27815 1/20 0.45
ADRA1A P35348 1/20 0.45
KDR P35968 1/20 0.45
SLC6A3 Q01959 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL9245695 0.92 KMT2A (0.51) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL10997377 0.86 HPGD (0.55) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL9065172 0.81 HPGD (0.59) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL826069 0.80 HSD17B10 (0.55) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL29257747 0.77 NSD2 (0.50) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL7219428 0.77 MAPT (0.67) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL2831844 0.75 KMT2A (0.68) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL1133083 0.75 HPGD (0.63) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL11690847 0.75 MAPT (0.53) HPGDALOX15HSD17B10MAPTKDM4E
SCHEMBL28379671 0.75 MAPT (0.63) HPGDALOX15HSD17B10MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5481032-A Process for the preparation of halogenated benzoic acids HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-02 US disclosed
EP-0355774-B1 Nucleus-fluorinated aromatic carboxylates and processes for their production ASAHI GLASS CO LTD (JP) 1995-04-26 EP disclosed
US-4985588-A Nucleus-fluorinated aromatic carboxylates and processes for their production ASAHI GLASS COMPANY LTD. (JP) 1991-01-15 US disclosed
EP-0355774-A2 Nucleus-fluorinated aromatic carboxylates and processes for their production ASAHI GLASS COMPANY LTD. (JP) 1990-02-28 EP disclosed