SCHEMBL3094429

SCHEMBL3094429

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.41
▸ RAB9A P51151 5/20 0.41
▸ NPC1 O15118 4/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ DHODH Q02127 1/20 0.39
▸ CSGALNACT1 Q8TDX6 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ DGAT1 O75907 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ LMNA P02545 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
SCHEMBL3094855 1.00 MAPT (0.41) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL3103404 0.86 NPC1 (0.44) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL3103296 0.85 MAPT (0.46) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL3100385 0.84 MEN1 (0.45) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL3094868 0.83 ALDH1A1 (0.41) MAPTRAB9ANPC1ALDH1A1KMT2A
SCHEMBL3226478 0.83 NPC1 (0.56) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL3225976 0.83 NPC1 (0.56) MAPTRAB9ANPC1ALDH1A1MEN1
SCHEMBL3092947 0.83 JAK3 (0.52) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL3092727 0.81 HTR2C (0.46) MAPTRAB9AMEN1KMT2ADGAT1
SCHEMBL3100609 0.81 MEN1 (0.44) MAPTMEN1KMT2ADGAT1MAPK1

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-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

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 MAPT 3315/4885RAB9A 1741/4885NPC1 2959/4885
US-20100234307-A1 PREPARATION AND USE OF BIPHENYL AMINO ACID DERIVATIVES FOR THE TREATMENT OF OBESITY BCAT2, BCAT1, FABP4 MAPT 3315/4885RAB9A 1741/4885NPC1 2959/4885

“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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