SCHEMBL3555545

SCHEMBL3555545

CC(=O)CNc1ccc(CCCCCc2ccccc2C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 8/20 0.50
PLK1 P53350 4/20 0.49
FOLH1 Q04609 1/20 0.47
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HIF1A Q16665 1/20 0.45
PLK3 Q9H4B4 3/20 0.44
BID P55957 1/20 0.43
BCL2L1 Q07817 1/20 0.43
MCL1 Q07820 1/20 0.43
BAK1 Q16611 1/20 0.43
HDAC1 Q13547 1/20 0.43

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
SCHEMBL11710027 0.79 FOLH1 (0.61) SLC16A3FOLH1SMN1; SMN2BIDBCL2L1
SCHEMBL3554093 0.77 HDAC3 (0.56) SLC16A3SMN1; SMN2HDAC1
SCHEMBL9345842 0.77 FOLH1 (0.68) SLC16A3FOLH1BIDBCL2L1MCL1
SCHEMBL10641089 0.76 TSHR (0.68) SLC16A3PLK1FOLH1PLK3
SCHEMBL20162476 0.75 FOLH1 (0.61) SLC16A3FOLH1SMN1; SMN2BIDBCL2L1
SCHEMBL729909 0.75 FOLH1 (0.70) SLC16A3FOLH1KDM4ESMN1; SMN2BID
SCHEMBL370919 0.75 SLC16A3 (0.58) SLC16A3PLK1FOLH1BIDBCL2L1
SCHEMBL9644336 0.75 SLC16A3 (0.62) SLC16A3PLK1FOLH1PLK3BID
SCHEMBL10641755 0.75 CYP4A11 (0.60) SLC16A3PLK1LMNAPLK3
SCHEMBL6486936 0.74 MEN1 (0.48) SLC16A3PLK1KDM4EPLK3

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 SLC16A3 425/4885PLK1 4876/4885FOLH1 1283/4885

“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.