SCHEMBL9631343

SCHEMBL9631343

CCOC(=O)[C@H](Cc1ccc(N)cc1)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.97

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.60
▸ ALDH1A1 P00352 5/20 0.56
▸ POLB P06746 3/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ GAA P10253 2/20 0.55
▸ MAPT P10636 4/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ PKM P14618 1/20 0.46
▸ HTT P42858 2/20 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
Hydrochloric Acid SCHEMBL9630160 0.99 HSD11B1 (0.59) HSD11B1ALDH1A1POLBL3MBTL1GAA
SCHEMBL21715106 0.91 HSD11B1 (0.71) HSD11B1ALDH1A1POLBL3MBTL1GAA
SCHEMBL1597751 0.88 ALDH1A1 (0.57) HSD11B1ALDH1A1POLBL3MBTL1GAA
SCHEMBL10768539 0.82 ALDH1A1 (0.80) ALDH1A1POLBL3MBTL1GAAKMT2A
SCHEMBL11026630 0.81 ALDH1A1 (0.54) HSD11B1ALDH1A1POLBL3MBTL1GAA
SCHEMBL8064549 0.81 ALDH1A1 (0.55) HSD11B1ALDH1A1POLBL3MBTL1GAA
SCHEMBL11778138 0.81 ALDH1A1 (0.55) HSD11B1ALDH1A1POLBL3MBTL1GAA
SCHEMBL21501052 0.80 HSD11B1 (0.67) HSD11B1ALDH1A1POLBL3MBTL1GAA
SCHEMBL23578402 0.79 BACE1 (0.48) HSD11B1ALDH1A1POLBL3MBTL1MAPT
SCHEMBL23578399 0.79 BACE1 (0.48) HSD11B1ALDH1A1POLBL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4997651-A Melphalan, antitumor BURROUGHS WELLCOME CO. 1991-03-05 — — US claimed
EP-0317281-A2 Pharmaceutical formulations containing melphalan or melphalan hydrochloride, as well as melphalan and melphalan hydrochloride and processes for preparing them THE WELLCOME FOUNDATION LIMITED (GB) 1989-05-24 — — EP claimed
US-11787761-B2 Process for the synthesis of Melphalan INDENA S.P.A. (IT) 2023-10-17 — — US disclosed
US-20230286901-A1 PROCESS FOR THE SYNTHESIS OF MELPHALAN INDENA S.P.A. (IT) 2023-09-14 — — US disclosed
WO-2021130163-A1 A PROCESS FOR THE SYNTHESIS OF MELPHALAN INDENA S.P.A. (IT) 2021-07-01 — — WO disclosed
EP-0317281-B1 PHARMACEUTICAL FORMULATIONS CONTAINING MELPHALAN OR MELPHALAN HYDROCHLORIDE, AS WELL AS MELPHALAN AND MELPHALAN HYDROCHLORIDE AND PROCESSES FOR PREPARING THEM THE WELLCOME FOUNDATION LIMITED (GB) 1992-12-30 — — EP disclosed
US-4997651-A Melphalan, antitumor BURROUGHS WELLCOME CO. 1991-03-05 — — US disclosed
EP-0317281-A2 Pharmaceutical formulations containing melphalan or melphalan hydrochloride, as well as melphalan and melphalan hydrochloride and processes for preparing them THE WELLCOME FOUNDATION LIMITED (GB) 1989-05-24 — — 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-11787761-B2 Process for the synthesis of Melphalan PAH, TYR, MARS1 HSD11B1 4793/4885ALDH1A1 2246/4885POLB 1783/4885
US-20230286901-A1 PROCESS FOR THE SYNTHESIS OF MELPHALAN PAH, TYR, IL4I1 HSD11B1 4789/4885ALDH1A1 2234/4885POLB 1984/4885

“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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