SCHEMBL2734207

SCHEMBL2734207

COC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(N)CCCCN

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 7/20 0.52
▸ LNPEP Q9UIQ6 6/20 0.52
▸ ERAP1 Q9NZ08 3/20 0.51
▸ DPP8 Q6V1X1 2/20 0.49
▸ DPP9 Q86TI2 2/20 0.49
▸ DPP7 Q9UHL4 2/20 0.49
▸ GNAI3 P08754 1/20 0.46
▸ GNAO1 P09471 1/20 0.46
▸ GNAI1 P63096 1/20 0.46
▸ NPY4R P50391 2/20 0.44
▸ NPY1R P25929 1/20 0.44
▸ DPP4 P27487 1/20 0.43
▸ GSR P00390 1/20 0.43
▸ SSTR3 P32745 1/20 0.42
▸ SIRT6 Q8N6T7 1/20 0.42
▸ SIRT1 Q96EB6 1/20 0.42
▸ NMT2 O60551 1/20 0.41
▸ NMT1 P30419 1/20 0.41

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
SCHEMBL13496274 0.97 ERAP2 (0.54) ERAP2LNPEPERAP1DPP8DPP9
SCHEMBL14560933 0.90 GNAI3 (0.60) ERAP2LNPEPERAP1DPP7GNAI3
SCHEMBL14560924 0.90 GNAI3 (0.60) ERAP2LNPEPERAP1DPP7GNAI3
SCHEMBL2734071 0.88 ERAP2 (0.49) ERAP2LNPEPERAP1DPP8DPP9
SCHEMBL13561938 0.87 ERAP2 (0.47) ERAP2LNPEPERAP1DPP8DPP9
SCHEMBL463738 0.87 ERAP2 (0.47) ERAP2LNPEPERAP1DPP8DPP9
SCHEMBL24198900 0.87 FOLH1 (0.51) ERAP2LNPEPERAP1DPP8DPP9
SCHEMBL21454270 0.87 FOLH1 (0.51) ERAP2LNPEPERAP1DPP8DPP9
SCHEMBL27182532 0.85 ERAP2 (0.47) ERAP2LNPEPERAP1DPP8DPP9
SCHEMBL13496278 0.85 NMT1 (0.47) ERAP2LNPEPERAP1SSTR3SIRT6

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-8088757-B2 Betulinol derivatives as anti-cancer agents BIORINGS LLC (US) 2012-01-03 — — US disclosed
US-8088757-B2 Betulinol derivatives as anti-cancer agents BIORINGS LLC (US) 2012-01-03 — — US disclosed
US-20090176753-A1 Betulinol derivatives as anti-cancer agents SAXENA RESEARCH, LLC 2009-07-09 — — US disclosed
US-20090176753-A1 Betulinol derivatives as anti-cancer agents SAXENA RESEARCH, LLC 2009-07-09 — — 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 (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-20090176753-A1 Betulinol derivatives as anti-cancer agents BET1, BRDT, BRCA1 ERAP2 4039/4885LNPEP 3532/4885ERAP1 3295/4885

“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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