SCHEMBL3564054

SCHEMBL3564054

CCS(=O)(=O)Nc1ccc(CCc2cccc(C(=O)O)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.57
LMNA P02545 2/20 0.57
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
AKR1C3 P42330 3/20 0.47
AR P10275 1/20 0.47
SLC16A3 O15427 3/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
FOLH1 Q04609 1/20 0.45

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
SCHEMBL3557354 0.95 HPGD (0.55) HPGDLMNAHTTSMN1; SMN2CA1
SCHEMBL3554342 0.90 LMNA (0.51) HPGDLMNAAKR1C3SLC16A3KMT2A
SCHEMBL3559039 0.89 AR (0.52) HPGDLMNACA1CA2AR
SCHEMBL3557393 0.88 HPGD (0.59) HPGDCA1CA2AKR1C3AR
SCHEMBL3560646 0.88 KDM4E (0.49) HPGDLMNAHTTSMN1; SMN2CA1
SCHEMBL3555543 0.86 HPGD (0.50) HPGDLMNAHTTSMN1; SMN2
SCHEMBL3555917 0.86 HPGD (0.62) HPGDLMNAHTTSMN1; SMN2AR
SCHEMBL3552908 0.84 CA1 (0.46) CA1CA2AKR1C3SLC16A3MEN1
SCHEMBL3555334 0.84 KAT6A (0.56) CA1CA2SLC16A3MEN1KMT2A
SCHEMBL3555180 0.84 ALDH1A1 (0.57) CA1CA2SLC16A3MEN1KMT2A

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 HPGD 389/4885LMNA 2120/4885HTT 3739/4885

“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.