SCHEMBL1490635

SCHEMBL1490635

COc1c(F)cc(C(=O)Nc2csc(-c3cccc(C)c3)c2C(=O)O)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.43
▸ KMT2A Q03164 8/20 0.43
▸ DHODH Q02127 3/20 0.41
▸ GFER P55789 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ PKM P14618 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.36
▸ ABCB1 P08183 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ ATM Q13315 2/20 0.36
▸ PRNP P04156 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ IL2 P60568 1/20 0.35
▸ RAB9A P51151 1/20 0.35

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
SCHEMBL1490447 0.93 MEN1 (0.43) MEN1KMT2ADHODHGFERSMN1; SMN2
SCHEMBL1490193 0.91 DHODH (0.41) MEN1KMT2ADHODHSMN1; SMN2NPC1
SCHEMBL1490362 0.91 DHODH (0.52) MEN1KMT2ADHODHSMN1; SMN2HDAC2
SCHEMBL1490654 0.91 DHODH (0.41) MEN1KMT2ADHODHNPC1PKM
SCHEMBL1490162 0.90 DHODH (0.40) MEN1KMT2ADHODHSMN1; SMN2KDM4E
SCHEMBL1490385 0.90 PTGFR (0.41) MEN1KMT2ADHODHKDM4ENPC1
SCHEMBL1490216 0.90 KMT2A (0.41) MEN1KMT2ADHODHGFERSMN1; SMN2
SCHEMBL1490474 0.89 MEN1 (0.43) MEN1KMT2ADHODHGFERSMN1; SMN2
SCHEMBL1490494 0.86 MEN1 (0.40) MEN1KMT2ADHODHNPC1ABCB1
SCHEMBL1490379 0.85 MEN1 (0.48) MEN1KMT2ADHODHSMN1; SMN2HDAC2

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-20140051711-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2014-02-20 — — US disclosed
US-8618307-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2013-12-31 — — US disclosed
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-03-17 — — 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 (2 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-20140051711-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 MEN1 2958/4885KMT2A 4706/4885DHODH 2153/4885
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 MEN1 2958/4885KMT2A 4706/4885DHODH 2153/4885

“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.

Send feedback