Metamelfalan

Metamelfalan

SCHEMBL2015275

N[C@@H](Cc1cccc(N(CCCl)CCCl)c1)C(=O)O

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 3/20 0.70
▸ ALOX15 P16050 3/20 0.70
▸ HIF1A Q16665 3/20 0.70
▸ PTGS1 P23219 3/20 0.70
▸ ALDH1A1 P00352 2/20 0.70
▸ SMN1; SMN2 Q16637 2/20 0.70
▸ TDP1 Q9NUW8 2/20 0.70
▸ KDM4E B2RXH2 2/20 0.70
▸ LMNA P02545 2/20 0.70
▸ ABCB11 O95342 1/20 0.70
▸ CHRM2 P08172 1/20 0.70
▸ ADRA2A P08913 1/20 0.70
▸ CHRM1 P11229 1/20 0.70
▸ ACHE P22303 1/20 0.70
▸ OPRM1 P35372 1/20 0.70
▸ DRD3 P35462 1/20 0.70
▸ SLC6A3 Q01959 1/20 0.70
▸ KCNH2 Q12809 1/20 0.70
▸ CYP1A2 P05177 1/20 0.70
▸ NFKB1 P19838 1/20 0.70

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
Metamelfalan SCHEMBL30781236 1.00 CYP3A4 (0.70) CYP3A4ALOX15HIF1APTGS1ALDH1A1
Metamelfalan SCHEMBL6842568 1.00 CYP3A4 (0.70) CYP3A4ALOX15HIF1APTGS1ALDH1A1
Metamelfalan SCHEMBL2015272 1.00 CYP3A4 (0.70) CYP3A4ALOX15HIF1APTGS1ALDH1A1
Melphalan SCHEMBL4984726 0.84 HIF1A (0.91) CYP3A4ALOX15HIF1APTGS1ALDH1A1
SCHEMBL18427979 0.84 IDO1 (0.57) CYP3A4ALOX15HIF1APTGS1ALDH1A1
SCHEMBL19714971 0.84 IDO1 (0.57) CYP3A4ALOX15HIF1APTGS1ALDH1A1
SCHEMBL18427948 0.84 IDO1 (0.57) CYP3A4ALOX15HIF1APTGS1ALDH1A1
SCHEMBL6843476 0.83 SMN1; SMN2 (0.53) CYP3A4ALOX15HIF1APTGS1ALDH1A1
SCHEMBL2778981 0.83 NOS3 (0.56) CYP3A4ALOX15HIF1APTGS1ALDH1A1
SCHEMBL2778977 0.83 NOS3 (0.56) CYP3A4ALOX15HIF1APTGS1ALDH1A1

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 106 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9016221-B2 Surface topographies for non-toxic bioadhesion control UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-04-28 — — US claimed
US-20100226943-A1 SURFACE TOPOGRAPHIES FOR NON-TOXIC BIOADHESION CONTROL UNIVERSITY OF FLORIDA (US) 2010-09-09 — — US claimed
CN-101330905-A Freeze-drying process and products obtained thereby SCIDOSE LLC (US) 2008-12-24 — — CN claimed
EP-1954244-A1 LYOPHILIZATION PROCESS AND PRODUCTS OBTAINED THEREBY Scidose, Llc (US) 2008-08-13 — — EP claimed
CN-101066453-A Solid tumor treating medicine composition SHANDONG LANJIN BIOENGINEERING (CN) 2007-11-07 — — CN claimed
CN-101066452-A Solid tumor treating medicine composition containing SHANDONG LANJIN BIOENGINEERING (CN) 2007-11-07 — — CN claimed
CN-101066454-A Solid tumor treating medicine composition SHANDONG LANJIN BIOENGINEERING (CN) 2007-11-07 — — CN claimed
CN-101066451-A Solid tumor treating medicine composition containing dicloethamine SHANDONG LANJIN BIOENGINEERING (CN) 2007-11-07 — — CN claimed
WO-2007061529-A1 LYOPHILIZATION PROCESS AND PRODUCTS OBTAINED THEREBY SCIDOSE LLC. (US) 2007-05-31 — — WO claimed
US-20070116729-A1 Lyophilization process and products obtained thereby SCIDOSE LLC 2007-05-24 — — US claimed
CN-1923280-A Anti-cancer slow release injection containing dichloroethylaminum KONG QINGZHONG (CN) 2007-03-07 — — CN claimed
CN-1686550-A Solid tumor resisting pharmaceutical composition containing dicloethamine SHANDONG LANJIN BIOLOG ENGINEE (CN) 2005-10-26 — — CN claimed
CN-1686551-A Anti-solid tumor pharmaceutical composition SHANDONG LANJIN BIOLOG ENGINEE (CN) 2005-10-26 — — CN claimed
CN-1679947-A Anticarcinogen composition LANJIN BIOLOG ENGINEERING CO L (CN) 2005-10-12 — — CN claimed
US-20220047505-A1 Controlled Absorption Water-Soluble Pharmaceutically Active Organic Compound Formulation for Once-Daily Administration STI PHARMA, LLC (US) 2022-02-17 — — US disclosed
US-11191719-B2 Controlled absorption water-soluble pharmaceutically active organic compound formulation for once-daily administration STI PHARMA, LLC (US) 2021-12-07 — — US disclosed
US-10463611-B2 Controlled absorption water-soluble pharmaceutically active organic compound formulation for once-daily administration STI PHARMA, LLC (US) 2019-11-05 — — US disclosed
EP-0056565-B1 DERIVATIVES OF DI(-2-CHLOROETHYL) AMINOPHENYL ALANINE WITH ANTITUMOUR ACTIVITY PROTER S.p.A. (IT) 1984-12-05 — — EP disclosed
US-4314999-A N-Acyl derivatives of glucosamine having antitumor chemotherapeutic acitivity PROTER S.P.A. (IT) 1982-02-09 — — US disclosed
US-4216208-A N-Acyl derivatives of glucosamines having antitumor chemotherapeutic activity PROTER S.P.A. (IT) 1980-08-05 — — US disclosed
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