SCHEMBL3345659

SCHEMBL3345659

NCC(=O)Nc1ccccc1-c1nc2ccccc2o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 6/20 0.55
▸ TP53 P04637 4/20 0.49
▸ THRB P10828 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ MAPT P10636 5/20 0.47
▸ NPC1 O15118 4/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ PPARG P37231 1/20 0.47
▸ NCOA2 Q15596 1/20 0.47
▸ NCOA1 Q15788 1/20 0.47
▸ NPSR1 Q6W5P4 3/20 0.46
▸ USP2 O75604 1/20 0.46
▸ POLB P06746 1/20 0.45
▸ LMNA P02545 1/20 0.45

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
SCHEMBL10004971 0.91 HSD17B10 (0.54) HSD17B10TP53THRBMEN1KMT2A
Hydrochloric Acid SCHEMBL10923922 0.83 KMT2A (0.56) TP53MEN1KMT2AMAPTNPC1
SCHEMBL9042363 0.82 RAB9A (0.63) HSD17B10TP53THRBMAPTNPC1
SCHEMBL9045395 0.80 HSD17B10 (0.56) HSD17B10TP53THRBMAPTNPC1
SCHEMBL3337498 0.80 HSD17B10 (0.53) HSD17B10TP53THRBMAPTNPC1
SCHEMBL10005165 0.77 MAPT (0.53) HSD17B10TP53THRBMEN1KMT2A
SCHEMBL10005128 0.77 HSD17B10 (0.47) HSD17B10TP53THRBMEN1KMT2A
SCHEMBL10291489 0.74 ALDH1A1 (0.51) HSD17B10TP53MEN1KMT2AMAPT
SCHEMBL6094632 0.73 HSD17B10 (0.47) HSD17B10TP53THRBMEN1KMT2A
SCHEMBL10005074 0.73 LMNA (0.53) HSD17B10TP53THRBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2471944-B1 Novel peptidase substrates BIOMERIEUX SA (FR) 2016-09-14 — — EP disclosed
EP-2155892-B1 NOVEL PEPTIDASE SUBSTRATES BIOMERIEUX SA (FR) 2015-03-18 — — EP disclosed
EP-2155892-B1 NOVEL PEPTIDASE SUBSTRATES BIOMERIEUX SA (FR) 2015-03-18 — — EP disclosed
US-8216800-B2 Substrates for detecting peptidase activity and methods using the substrates BIOMERIEUX (FR) 2012-07-10 — — US disclosed
US-8216800-B2 Substrates for detecting peptidase activity and methods using the substrates BIOMERIEUX (FR) 2012-07-10 — — US disclosed
EP-2471944-A1 Novel peptidase substrates bioMérieux (FR) 2012-07-04 — — EP disclosed
US-20100099128-A1 NOVEL PEPTIDASE SUBSTRATES BIOMERIEUX (FR) 2010-04-22 — — US disclosed
US-20100099128-A1 NOVEL PEPTIDASE SUBSTRATES BIOMERIEUX (FR) 2010-04-22 — — US disclosed
EP-2155892-A2 NOVEL PEPTIDASE SUBSTRATES BIOMERIEUX (FR) 2010-02-24 — — EP disclosed
WO-2008152306-A2 NOVEL PEPTIDASE SUBSTRATES bioMérieux (FR) 2008-12-18 — — WO 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-20100099128-A1 NOVEL PEPTIDASE SUBSTRATES XPNPEP1, DPEP1, DDAH1 HSD17B10 1530/4885TP53 3157/4885THRB 2329/4885

“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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