SCHEMBL6926728

SCHEMBL6926728

Cc1ccc(-c2csc(NC(=O)c3sccc3O)c2C(=O)O)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.50
KMT2A Q03164 10/20 0.50
ANO1 Q5XXA6 7/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 3/20 0.49
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
GRIN2C Q14957 1/20 0.43
PRNP P04156 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ANO2 Q9NQ90 1/20 0.42
NLRP3 Q96P20 1/20 0.42
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 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
SCHEMBL14803287 0.86 MEN1 (0.58) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6927236 0.84 MEN1 (0.50) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6926806 0.84 MEN1 (0.46) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6927478 0.84 ANO1 (0.53) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6926608 0.83 MEN1 (0.64) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6926791 0.82 MEN1 (0.50) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6926443 0.82 ANO1 (0.60) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6926060 0.82 ANO1 (0.56) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6924799 0.80 ANO1 (0.55) MEN1KMT2AANO1NPC1RAB9A
SCHEMBL6926609 0.79 ANO1 (0.54) MEN1KMT2AANO1NPC1RAB9A

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 3 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
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 MEN1 2958/4885KMT2A 4706/4885ANO1 114/4885

“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.