SCHEMBL3100385

SCHEMBL3100385

Cc1ccc(NC(=O)Nc2ccc(-c3ccc(S(=O)(=O)OC(=O)[C@@H]4CCCN4)cc3)cc2)c(C)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ PKM P14618 1/20 0.43
▸ CA2 P00918 3/20 0.42
▸ CA9 Q16790 3/20 0.42
▸ CA12 O43570 2/20 0.42
▸ CA1 P00915 2/20 0.42
▸ MAPT P10636 2/20 0.40
▸ BACE1 P56817 1/20 0.39
▸ CA4 P22748 1/20 0.39
▸ DHODH Q02127 1/20 0.39
▸ GLA P06280 1/20 0.38
▸ ENPP3 O14638 2/20 0.38
▸ ENPP1 P22413 2/20 0.38
▸ ENPP2 Q13822 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL3092264 0.91 IDH1 (0.45) CA2CA9CA12CA1MAPT
SCHEMBL3097301 0.88 NPC1 (0.42) MEN1KMT2APKMCA2DHODH
SCHEMBL3095748 0.84 JAK3 (0.51) MEN1KMT2ACA2CA9CA12
SCHEMBL3084068 0.84 CA12 (0.52) MEN1KMT2ACA2CA9CA12
SCHEMBL3094855 0.84 MAPT (0.41) MEN1KMT2AMAPTDHODHNPC1
SCHEMBL3094429 0.84 MAPT (0.41) MEN1KMT2AMAPTDHODHNPC1
SCHEMBL3094741 0.83 MEN1 (0.44) MEN1KMT2ACA2CA9CA12
SCHEMBL3105677 0.83 RAB9A (0.43) MEN1KMT2ACA2CA9CA12
SCHEMBL3095867 0.82 MEN1 (0.45) MEN1KMT2ACA2CA9CA12
SCHEMBL3097193 0.82 CA2 (0.43) MEN1KMT2ACA2CA9CA12

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 3 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-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 MEN1 4210/4885KMT2A 636/4885PKM 3381/4885
US-20100234307-A1 PREPARATION AND USE OF BIPHENYL AMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BCAT2, BCAT1, FABP4 MEN1 4210/4885KMT2A 636/4885PKM 3381/4885

“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.

Send feedback