SCHEMBL6926748

SCHEMBL6926748

Cc1ccc(-c2csc(NC(=O)c3cc(C(F)(F)F)ccc3O)c2C(=O)O)c(F)c1F

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 8/20 0.54
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
NPC1 O15118 2/20 0.44
TMPRSS4 Q9NRS4 3/20 0.43
SORT1 Q99523 2/20 0.43
RAB9A P51151 2/20 0.43
GRIN2C Q14957 2/20 0.42
ANO2 Q9NQ90 1/20 0.41
NLRP3 Q96P20 1/20 0.41
P2RX1 P51575 2/20 0.40
P2RX4 Q99571 1/20 0.40
P2RX7 Q99572 1/20 0.40

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
SCHEMBL14803174 0.93 ANO1 (0.46) ANO1MEN1KMT2ANPC1RAB9A
SCHEMBL14818539 0.92 ANO1 (0.52) ANO1MEN1KMT2ANPC1SORT1
SCHEMBL14803433 0.88 ANO1 (0.53) ANO1MEN1KMT2ANPC1RAB9A
SCHEMBL14818447 0.88 ANO1 (0.53) ANO1MEN1KMT2ANPC1RAB9A
SCHEMBL14818548 0.87 ANO1 (0.45) ANO1MEN1KMT2ANPC1RAB9A
SCHEMBL6926609 0.86 ANO1 (0.54) ANO1MEN1KMT2ANPC1TMPRSS4
SCHEMBL14803434 0.86 ANO1 (0.44) ANO1MEN1KMT2ANPC1RAB9A
SCHEMBL14803209 0.85 MEN1 (0.44) ANO1MEN1KMT2ANPC1RAB9A
SCHEMBL14818542 0.85 MEN1 (0.50) ANO1MEN1KMT2ANPC1RAB9A
SCHEMBL14803175 0.85 ANO1 (0.54) ANO1MEN1KMT2ANPC1TMPRSS4

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-20130079348-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2013-03-28 US disclosed
WO-2011109551-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-09-09 WO 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-20130079348-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 ANO1 114/4885MEN1 2958/4885KMT2A 4706/4885

“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.