SCHEMBL6926424

SCHEMBL6926424

Cc1ccc(F)cc1-c1csc(NC(=O)c2nc3ccccc3o2)c1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.46
MEN1 O00255 8/20 0.46
RAB9A P51151 3/20 0.46
NLRP3 Q96P20 1/20 0.46
NPC1 O15118 4/20 0.44
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ANO1 Q5XXA6 4/20 0.42
ANO2 Q9NQ90 1/20 0.42
MAPT P10636 2/20 0.40
HSD17B10 Q99714 2/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
PTPN1 P18031 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RXFP1 Q9HBX9 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
SCHEMBL1954204 0.89 MEN1 (0.47) KMT2AMEN1RAB9ANLRP3NPC1
SCHEMBL1954397 0.89 MEN1 (0.45) KMT2AMEN1RAB9ANLRP3NPC1
SCHEMBL1954089 0.86 MEN1 (0.51) KMT2AMEN1RAB9ANLRP3NPC1
SCHEMBL6925697 0.86 NPC1 (0.39) KMT2AMEN1RAB9ANPC1TP53
SCHEMBL2180967 0.86 MEN1 (0.46) KMT2AMEN1RAB9ANLRP3NPC1
SCHEMBL1954798 0.85 MEN1 (0.49) KMT2AMEN1RAB9ANLRP3NPC1
SCHEMBL1951570 0.85 MEN1 (0.44) KMT2AMEN1RAB9ANLRP3NPC1
SCHEMBL1900123 0.85 MEN1 (0.44) KMT2AMEN1RAB9ANLRP3NPC1
SCHEMBL1894769 0.85 MEN1 (0.50) KMT2AMEN1RAB9ANLRP3NPC1
SCHEMBL1896499 0.85 MEN1 (0.43) KMT2AMEN1RAB9ANLRP3NPC1

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 KMT2A 4706/4885MEN1 2958/4885RAB9A 1174/4885

“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.