SCHEMBL6237773

SCHEMBL6237773

C[C@@H](C(=O)N(C)Cc1ccccc1)N(C(=O)OC(C)(C)C)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.45
HPGD P15428 1/20 0.44
METAP2 P50579 2/20 0.43
HCRTR1 O43613 1/20 0.42
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
RIPK1 Q13546 1/20 0.39
CTSG P08311 1/20 0.39
MCL1 Q07820 1/20 0.38
METAP1 P53582 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 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
SCHEMBL7229620 0.84 SMPD2 (0.41) BACE1CTSSKMT2AMEN1ALDH1A1
SCHEMBL1432658 0.84 SMPD2 (0.41) BACE1CTSSKMT2AMEN1ALDH1A1
SCHEMBL1326634 0.84 SMPD2 (0.41) BACE1CTSSKMT2AMEN1ALDH1A1
SCHEMBL8691508 0.80 HPGD (0.44) HPGDCTSLCTSBCTSSCHRNB2
SCHEMBL27597531 0.79 MEN1 (0.40) BACE1HPGDCTSSKMT2AMEN1
SCHEMBL6139113 0.79 MEN1 (0.40) BACE1HPGDCTSSKMT2AMEN1
SCHEMBL7442872 0.78 BACE1 (0.39) BACE1HPGDCTSSKMT2AALDH1A1
SCHEMBL10608817 0.77 CTSS (0.41) BACE1HPGDCTSSALDH1A1
SCHEMBL7190668 0.74 RIPK1 (0.57) HPGDCTSLCTSBCTSSCHRNB2
SCHEMBL7878077 0.74 CTSS (0.63) METAP2CTSLCTSBCTSS

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6927290-B2 Production of mixed acid anhydride and amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-08-09 US disclosed
EP-1160236-B1 Production of mixed acid anhydride and amine compound SUMITOMO CHEMICAL CO (JP) 2005-05-25 EP disclosed
US-20040210059-A1 Production of mixed acid anhydride and amide compound SUMITOMO CHEMICAL COMPANY, LIMITED 2004-10-21 US disclosed
US-6753431-B2 REACTING A CARBAMATE DERIVATIVE WITH CARBOXYLIC AND HALOFORMIC ACID DERIVATIVES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2004-06-22 US disclosed
US-20020032346-A1 Production of mixed acid anhydride and amide compound SUMITOMO CHEMICAL CO., LTD. 2002-03-14 US disclosed
EP-1160236-A2 Production of mixed acid anhydride and amine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-12-05 EP 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-20040210059-A1 Production of mixed acid anhydride and amide compound CA2, CA1, CA3 BACE1 3681/4885HPGD 2590/4885METAP2 1513/4885
US-20020032346-A1 Production of mixed acid anhydride and amide compound CA2, CA1, CA3 BACE1 3681/4885HPGD 2590/4885METAP2 1513/4885

“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.