SCHEMBL3488928

SCHEMBL3488928

COc1ccc(C(=O)N(C(C)C)[C@@H]2CCCN(C(=O)O)C2)cc1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
TRPM8 Q7Z2W7 1/20 0.48
KMT2A Q03164 3/20 0.47
SMPD1 P17405 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HPGD P15428 2/20 0.45
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HSD17B10 Q99714 1/20 0.44
REN P00797 2/20 0.43
APP P05067 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL3488941 0.91 REN (0.48) NPC1RAB9ATRPM8HSD17B10REN
SCHEMBL13434314 0.90 NPC1 (0.46) NPC1RAB9ATRPM8KMT2ASMPD1
SCHEMBL3488892 0.87 REN (0.53) REN
SCHEMBL3487423 0.87 REN (0.53) REN
SCHEMBL13434234 0.85 REN (0.52) REN
SCHEMBL13434238 0.85 REN (0.52) REN
SCHEMBL13630938 0.85 REN (0.52) REN
SCHEMBL3487502 0.84 REN (0.43) RAB9AHPGDHSD17B10REN
SCHEMBL3489301 0.83 HSD11B1 (0.44) KMT2AHPGDMEN1ALDH1A1HSD17B10
SCHEMBL3487499 0.83 REN (0.51) REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056497-A1 AMIDE DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2010-03-04 US disclosed
EP-2119702-A1 AMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2009-11-18 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 (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-20100056497-A1 AMIDE DERIVATIVE REN, AGTR1, AGTR2 NPC1 1212/4885RAB9A 258/4885TRPM8 3410/4885

“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.