SCHEMBL3554633

SCHEMBL3554633

O=C(Nc1ccccc1CCCCCc1ccccc1C(=O)O)c1ccc(Cl)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 10/20 1.00
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
ALDH1A1 P00352 3/20 0.52
RAB9A P51151 3/20 0.52
HTT P42858 2/20 0.52
NPC1 O15118 2/20 0.52
KCNH2 Q12809 1/20 0.52
PLK1 P53350 3/20 0.49
PLK3 Q9H4B4 3/20 0.49
LMNA P02545 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ABL1 P00519 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
RIN1 Q13671 1/20 0.48
PKM P14618 1/20 0.48
MITF O75030 1/20 0.47

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
SCHEMBL3557714 0.87 SLC16A3 (0.78) SLC16A3MEN1KMT2ARAB9ANPC1
SCHEMBL3558403 0.86 SLC16A3 (1.00) SLC16A3MEN1KMT2APKM
SCHEMBL3552419 0.86 SLC16A3 (0.83) SLC16A3MEN1KMT2AALDH1A1RAB9A
SCHEMBL3559571 0.85 SLC16A3 (0.83) SLC16A3MEN1KMT2APLK1PLK3
SCHEMBL3559506 0.85 SLC16A3 (1.00) SLC16A3RAB9ANPC1
SCHEMBL3564050 0.84 SLC16A3 (1.00) SLC16A3KMT2AALDH1A1RAB9APLK1
SCHEMBL3559776 0.82 SLC16A3 (0.78) SLC16A3MEN1KMT2APLK1PLK3
SCHEMBL3556329 0.82 SLC16A3 (1.00) SLC16A3PLK1PLK3
SCHEMBL3552458 0.82 SLC16A3 (1.00) SLC16A3MEN1KMT2APLK1PLK3
SCHEMBL3555922 0.81 SLC16A3 (0.69) SLC16A3MEN1KMT2APLK1PLK3

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 425/4885MEN1 2548/4885KMT2A 4045/4885

“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.