SCHEMBL19465254

SCHEMBL19465254

CC(O)(c1cc(Cc2cc(I)c(N)c(C(O)(C(F)(F)F)C(F)(F)F)c2)cc(I)c1N)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 2/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
ATM Q13315 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL15745659 0.94 AR (0.30)
SCHEMBL15764633 0.91 MEN1 (0.44) MEN1KMT2ASMN1; SMN2KDM4EMAPT
SCHEMBL15745662 0.79 AR (0.32) MEN1KMT2ASMN1; SMN2KDM4EMAPT
SCHEMBL15745652 0.77 AR (0.34) SMN1; SMN2ALDH1A1POLB
SCHEMBL15745661 0.76 ADRB2 (0.40)
SCHEMBL15745658 0.76 ADRB2 (0.39) KDM4ELMNATSHR
SCHEMBL15733061 0.75 SMN1; SMN2 (0.45) MEN1KMT2ASMN1; SMN2KDM4EMAPT
SCHEMBL15764632 0.75 MEN1 (0.46) MEN1KMT2ASMN1; SMN2KDM4EMAPT
SCHEMBL15745646 0.75 HSPA5 (0.38) HTTPOLB
SCHEMBL26328002 0.74 SMN1; SMN2 (0.55) MEN1KMT2ASMN1; SMN2KDM4EMAPT

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
US-9793483-B2 Hexafluoroisopropanol group-containing diamine, polyimide and polyamide using same, cyclized product thereof, and method for producing same CENTRAL GLASS COMPANY, LIMITED (JP) 2017-10-17 US disclosed