SCHEMBL464952

SCHEMBL464952

CO[C@H](CC(N)=O)CC(=O)NCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
HPGD P15428 2/20 0.51
MEN1 O00255 2/20 0.51
PLA2G1B P04054 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51
ALDH1A1 P00352 4/20 0.49
MAPT P10636 2/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 1/20 0.49
TACR1 P25103 1/20 0.48
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.46
TNF P01375 1/20 0.46
SMN1; SMN2 Q16637 2/20 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
SCHEMBL5549476 1.00 KMT2A (0.51) KMT2AHPGDMEN1PLA2G1BATG4B
SCHEMBL6814349 0.86 HPGD (0.61) KMT2AHPGDMEN1ALDH1A1RAB9A
SCHEMBL6813232 0.84 SRC (0.48) HPGDALDH1A1RAB9A
SCHEMBL28409790 0.81 KMT2A (0.55) KMT2AHPGDMEN1PLA2G1BATG4B
SCHEMBL14743543 0.79 SRR (0.46) KMT2AMEN1ALDH1A1RAB9ANPC1
SCHEMBL27963510 0.78 PLA2G1B (0.58) KMT2AHPGDMEN1PLA2G1BATG4B
SCHEMBL27963512 0.78 KMT2A (0.55) KMT2AHPGDMEN1PLA2G1BATG4B
SCHEMBL17087481 0.77 MEN1 (0.55) KMT2AHPGDMEN1PLA2G1BATG4B
SCHEMBL338918 0.76 MMP8 (0.54) KMT2AHPGDMEN1PLA2G1BATG4B
SCHEMBL3659473 0.76 PLA2G1B (0.53) KMT2AHPGDMEN1PLA2G1BATG4B

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-20130316953-A1 NEW USES FOR AMINO ACID ANTICONVULSANTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 2013-11-28 US claimed
EP-2210598-B1 Anticonvulsant amino acids for the treatment of pain RES CORP TECHNOLOGIES INC (US) 2013-09-18 EP claimed
EP-1915140-B1 NOVEL USE OF PEPTIDE COMPOUNDS FOR TREATING MUSCLE PAIN UCB PHARMA GMBH (DE) 2011-11-23 EP claimed
EP-1695703-B1 Anticonvulsant amino acids for the treatment of obsessive-compulsive neurosis RES CORP TECHNOLOGIES INC (US) 2010-08-11 EP claimed
EP-2210598-A2 Anticonvulsant amino acids for the treatment of pain Research Corporation Technologies, Inc. (US) 2010-07-28 EP claimed
EP-1373300-B1 NOVEL USE OF A PEPTIDE CLASS OF COMPOUND FOR TREATING NON NEUROPATHIC INFLAMMATORY PAIN SANOL ARZNEI SCHWARZ GMBH (DE) 2009-05-20 EP claimed
US-20080280835-A1 Novel Use of Peptide Compounds For Treating Muscle Pain UCB PHARMA GMBH (DE) 2008-11-13 US claimed
EP-1915140-A2 NOVEL USE OF PEPTIDE COMPOUNDS FOR TREATING MUSCLE PAIN SCHWARZ PHARMA AG (DE) 2008-04-30 EP claimed
EP-1486205-B1 Use of anticonvulsant aminoacids for the treatment of migraine RES CORP TECHNOLOGIES INC (US) 2007-10-17 EP claimed
EP-1486206-B1 Uses of anticonvulsant aminoacids for the treatment of bipolar disorders RES CORP TECHNOLOGIES INC (US) 2007-10-17 EP claimed
US-6803481-B2 TREATING DIFFERENT TYPES AND SYMPTOMS OF ACUTE AND CHRONIC PAIN, ESPECIALLY NON NEUROPATHIC INFLAMMATORY PAIN IN MAMMALS. THE PAIN TO BE TREATED MAY BE E.G. CHRONIC INFLAMMATORY PAIN, RHEUMATOID ARTHRITIS PAIN AND/OR SECONDARY SCHWARZ PHARMA AG (DE) 2004-10-12 US claimed
US-20040097416-A1 New uses for amino acid anticonvulsants RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 2004-05-20 US claimed
US-20040087508-A1 Users for amino acid anticonvulsants RESEARCH CORPORATION TECHNOLOGIES, INC. 2004-05-06 US claimed
EP-1373300-A2 NOVEL USE OF A PEPTIDE CLASS OF COMPOUND FOR TREATING NON NEUROPATHIC INFLAMMATORY PAIN SCHWARZ PHARMA AG (DE) 2004-01-02 EP claimed
EP-1365787-A2 NEW USES FOR AMINO ACID ANTICONVULSANTS FOR TREATMENT OF PAIN Research Corporation Technologies, Inc (US) 2003-12-03 EP claimed
US-20030171300-A1 Treating different types and symptoms of acute and chronic pain, especially non neuropathic inflammatory pain in mammals. The pain to be treated may be e.g. chronic inflammatory pain, rheumatoid arthritis pain and/or secondary UCB PHARMA GMBH (DE) 2003-09-11 US claimed
WO-2002074784-A2 NOVEL USE OF A PEPTIDE CLASS OF COMPOUND FOR TREATING NON NEUROPATHIC INFLAMMATORY PAIN SCHWARZ PHARMA AG (DE) 2002-09-26 WO claimed
EP-1243262-A1 Novel use of a peptide class of compound for treating non-neuropathic inflammatory pain SCHWARZ PHARMA AG (DE) 2002-09-25 EP claimed
US-20020086828-A1 Uses for amino acid anticonvulsants HARRIS ROBERT H (US) 2002-07-04 US claimed
WO-2002015922-A2 NEW USES FOR AMINO ACID ANTICONVULSANTS FOR TREATMENT OF PAIN RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 2002-02-28 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20020086828-A1 Uses for amino acid anticonvulsants SLC1A2, SLC1A1, SLC1A3 KMT2A 2585/4885HPGD 385/4885MEN1 560/4885
US-20080280835-A1 Novel Use of Peptide Compounds For Treating Muscle Pain MTPN, MUSK, TNNC1 KMT2A 4569/4885HPGD 1996/4885MEN1 4196/4885
US-20040087508-A1 Users for amino acid anticonvulsants SLC1A2, SLC1A1, SLC1A3 KMT2A 1884/4885HPGD 441/4885MEN1 654/4885
US-20130316953-A1 NEW USES FOR AMINO ACID ANTICONVULSANTS SLC1A2, SLC1A1, SLC1A3 KMT2A 2691/4885HPGD 539/4885MEN1 1053/4885
US-20040097416-A1 New uses for amino acid anticonvulsants SLC1A2, SLC1A1, SLC1A3 KMT2A 3090/4885HPGD 548/4885MEN1 757/4885
US-20030171300-A1 Treating different types and symptoms of acute and chronic pain, especially non neuropathic inflammatory pain in mammals. The pain to be treated may be e.g. chronic inflammatory pain, rheumatoid arthritis pain and/or secondary OPRK1, OPRL1, PTGER1 KMT2A 3253/4885HPGD 356/4885MEN1 4707/4885

“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.