SCHEMBL3092264

SCHEMBL3092264

Cc1cc(Cl)ccc1NC(=O)Nc1ccc(-c2ccc(S(=O)(=O)OC(=O)[C@@H]3CCCN3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 5/20 0.45
▸ JAK3 P52333 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CA2 P00918 7/20 0.41
▸ CA9 Q16790 6/20 0.41
▸ CA12 O43570 5/20 0.41
▸ CA1 P00915 5/20 0.41
▸ CA4 P22748 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ GRIK1 P39086 1/20 0.37

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
SCHEMBL3095748 0.92 JAK3 (0.51) JAK3MAPTHTTLMNACA2
SCHEMBL3100385 0.91 MEN1 (0.45) MAPTCA2CA9CA12CA1
SCHEMBL3094741 0.90 MEN1 (0.44) MAPTCA2CA9CA12CA1
SCHEMBL3097301 0.88 NPC1 (0.42) IDH1CA2ALDH1A1
SCHEMBL3097193 0.86 CA2 (0.43) MAPTHTTLMNACA2CA9
SCHEMBL3095867 0.84 MEN1 (0.45) MAPTLMNACA2CA9CA12
SCHEMBL3100409 0.84 NPC1 (0.42) MAPTLMNACA2CA9CA12
SCHEMBL3084068 0.83 CA12 (0.52) MAPTHTTLMNACA2CA9
SCHEMBL3105677 0.81 RAB9A (0.43) MAPTCA2CA9CA12CA1
SCHEMBL3100462 0.79 CA12 (0.49) MAPTLMNACA2CA9CA12

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-20100234307-A1 PREPARATION AND USE OF BIPHENYL AMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BAYER HEALTHCARE LLC (US) 2010-09-16 — — US claimed
US-20100016295-A1 Preparation and Use of Biphenyl Amino Acid Derivatives for the Treatment of Obesity BAYER HEALTHCARE LLC (US) 2010-01-21 — — US claimed
US-20100234307-A1 PREPARATION AND USE OF BIPHENYL AMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BAYER HEALTHCARE LLC (US) 2010-09-16 — — US disclosed
US-20100016295-A1 Preparation and Use of Biphenyl Amino Acid Derivatives for the Treatment of Obesity BAYER HEALTHCARE LLC (US) 2010-01-21 — — 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 (2 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-20100016295-A1 Preparation and Use of Biphenyl Amino Acid Derivatives for the Treatment of Obesity BCAT2, BCAT1, FABP4 IDH1 3463/4885JAK3 1323/4885MAPT 3315/4885
US-20100234307-A1 PREPARATION AND USE OF BIPHENYL AMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BCAT2, BCAT1, FABP4 IDH1 3463/4885JAK3 1323/4885MAPT 3315/4885

“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.

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