SCHEMBL16017394

SCHEMBL16017394

Cc1cc(F)c(C(=O)Nc2ccc(N(C)c3ccccc3C(F)(F)F)cc2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 2/20 0.44
HTT P42858 2/20 0.44
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
THRB P10828 1/20 0.41
NOX1 Q9Y5S8 1/20 0.41
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
TRPA1 O75762 4/20 0.39
GRM4 Q14833 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
NFKB1 P19838 1/20 0.39

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
SCHEMBL16019883 0.92 HDAC6 (0.45) HDAC6SMN1; SMN2LMNAHTTMEN1
SCHEMBL16017402 0.90 HDAC6 (0.47) HDAC6SMN1; SMN2LMNAHTTMEN1
SCHEMBL16017395 0.88 SMN1; SMN2 (0.43) HDAC6SMN1; SMN2LMNAHTTMEN1
SCHEMBL16017397 0.88 LMNA (0.46) HDAC6SMN1; SMN2LMNAHTTMEN1
SCHEMBL16017399 0.88 SMN1; SMN2 (0.43) HDAC6SMN1; SMN2LMNAHTTMEN1
SCHEMBL16019884 0.88 HDAC6 (0.45) HDAC6SMN1; SMN2LMNAHTTMEN1
SCHEMBL16017392 0.86 ITGB1 (0.44) HDAC6SMN1; SMN2LMNAHTTMEN1
SCHEMBL16017405 0.83 NPC1 (0.58) HDAC6SMN1; SMN2LMNAHTTMEN1
SCHEMBL16019825 0.81 SMN1; SMN2 (0.38) SMN1; SMN2LMNAHTTTRPA1GAA
SCHEMBL14887629 0.81 SNCA (0.39) SMN1; SMN2LMNAHTTNPC1RAB9A

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-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. 2014-09-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 HDAC6 1662/4885SMN1; SMN2 854/4885LMNA 1306/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.