SCHEMBL28116838

SCHEMBL28116838

FC(F)(F)c1ccc(Cn2cc(Cl)cn2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.56
ALDH1A1 P00352 4/20 0.56
KDM4E B2RXH2 2/20 0.56
SMN1; SMN2 Q16637 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
HTT P42858 1/20 0.48
LMNA P02545 5/20 0.47
MAPT P10636 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
TP53 P04637 1/20 0.47
HPGD P15428 1/20 0.47
POLB P06746 2/20 0.47
EPHB4 P54760 2/20 0.46
TEK Q02763 1/20 0.46
GAA P10253 1/20 0.44
KCNH2 Q12809 1/20 0.44
ADORA2A P29274 1/20 0.42

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
SCHEMBL20758125 0.82 HSD17B10 (0.67) HSD17B10ALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL24628398 0.82 KMT2A (0.59) HSD17B10ALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL25583882 0.82 KLKB1 (0.51) EPHB4TEKKCNH2ADORA2AADORA2B
SCHEMBL710149 0.82 LMNA (0.67) ALDH1A1KDM4EL3MBTL1KMT2AMEN1
SCHEMBL25583711 0.81 TEK (0.47) ALDH1A1KDM4EL3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL21492320 0.80 LMNA (0.48) ALDH1A1KDM4ELMNAMAPTEPHB4
SCHEMBL24208605 0.80 TEK (0.46) ALDH1A1KDM4EL3MBTL1LMNAMAPT
SCHEMBL10249223 0.78 EPHB4 (0.43) HSD17B10ALDH1A1KDM4EL3MBTL1LMNA
SCHEMBL15661558 0.77 HSD17B10 (0.66) HSD17B10ALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL24871362 0.77 HSD17B10 (0.61) HSD17B10ALDH1A1KDM4ESMN1; SMN2L3MBTL1

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
CN-111349087-B Compounds and methods for inhibiting fascin 康奈尔大学 2023-07-14 CN disclosed
CN-111349087-A Compounds and methods for inhibiting fascin 康奈尔大学 2020-06-30 CN disclosed
CN-106232583-B Compounds and methods for inhibiting fascin 康奈尔大学 2020-04-24 CN disclosed
CN-106232583-A Compounds and methods for inhibiting fascin 康奈尔大学 2016-12-14 CN disclosed