SCHEMBL3559976

SCHEMBL3559976

O=C(O)c1ccc(OCCOc2ccccc2NC(=O)c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.60
CACNA1H O95180 5/20 0.59
CACNA1B Q00975 3/20 0.59
GAA P10253 1/20 0.57
PLK1 P53350 1/20 0.56
RAB9A P51151 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
NPC1 O15118 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
LMNA P02545 2/20 0.55
MAPT P10636 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
NR1H4 Q96RI1 3/20 0.52
CASP3 P42574 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
P4HTM Q9NXG6 1/20 0.51

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
SCHEMBL3557989 0.92 F10 (0.62) PKMCACNA1HCACNA1BGAAPLK1
SCHEMBL3555876 0.92 CACNA1H (0.57) PKMCACNA1HCACNA1BGAAPLK1
SCHEMBL3565241 0.92 KMT2A (0.57) PKMCACNA1HCACNA1BGAAPLK1
SCHEMBL3554988 0.90 GAA (0.57) PKMCACNA1HCACNA1BGAAPLK1
SCHEMBL3556306 0.90 RAB9A (0.56) PKMCACNA1HCACNA1BGAAPLK1
SCHEMBL3558076 0.88 SMN1; SMN2 (0.56) PKMCACNA1HCACNA1BGAAPLK1
SCHEMBL3552439 0.88 CACNA1H (0.52) PKMCACNA1HCACNA1BRAB9ASMN1; SMN2
SCHEMBL3568069 0.88 CACNA1H (0.53) PKMCACNA1HCACNA1BGAAPLK1
SCHEMBL3561367 0.87 PYGM (0.62) PKMCACNA1HCACNA1BRAB9ASMN1; SMN2
SCHEMBL3558462 0.86 PKM (0.54) PKMCACNA1HCACNA1BGAAPLK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816397-B2 Phenylcarboxylic acid derivatives and use thereof for the treatment of diabetes MERCK PATENT GMBH (DE) 2010-10-19 US claimed
US-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes MERCK PATENT GMBH (DE) 2008-02-21 US claimed
US-7816397-B2 Phenylcarboxylic acid derivatives and use thereof for the treatment of diabetes MERCK PATENT GMBH (DE) 2010-10-19 US disclosed
US-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes MERCK PATENT GMBH (DE) 2008-02-21 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-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes SLC5A1, ALDH7A1, ASS1 PKM 990/4885CACNA1H 2058/4885CACNA1B 1921/4885

“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.