SCHEMBL3555575

SCHEMBL3555575

Cc1cccc(S(=O)(=O)Nc2cccc(CCc3ccc(C(=O)O)cc3)c2)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
ALDH1A1 P00352 2/20 0.57
MAPT P10636 1/20 0.57
HPGD P15428 1/20 0.57
AKR1C3 P42330 2/20 0.57
LIMK1 P53667 1/20 0.54
LIMK2 P53671 1/20 0.54
HTR6 P50406 6/20 0.53
PFKFB3 Q16875 1/20 0.50
KDM1A O60341 1/20 0.47
SLC16A3 O15427 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
SCHEMBL3561858 0.92 MEN1 (0.65) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL3553349 0.92 ALDH1A1 (0.68) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL3556021 0.89 KDM1A (0.59) MEN1KMT2AALDH1A1AKR1C3LIMK1
SCHEMBL3555628 0.89 HTR6 (0.65) MEN1KMT2AAKR1C3LIMK1LIMK2
SCHEMBL3561276 0.88 AKR1C3 (0.63) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL3555871 0.88 POLB (0.60) MEN1KMT2AMAPTLIMK1LIMK2
SCHEMBL3558145 0.86 THRB (0.57) MEN1KMT2AALDH1A1MAPTLIMK2
SCHEMBL3560653 0.85 AKR1C3 (0.59) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL3553771 0.85 CA12 (0.61) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL3561244 0.85 ALDH1A1 (0.57) MEN1KMT2AALDH1A1MAPTLIMK1

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 MEN1 2548/4885KMT2A 4045/4885ALDH1A1 61/4885

“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.