Oxalic Acid

Oxalic Acid

SCHEMBL9613778

COc1ccc(C(N)CCOc2cccc3ccccc23)cc1.O=C(O)C(=O)O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1SLC6A4

The experimentally established mechanism targets of Oxalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 1/20 0.48
KMT2A Q03164 2/20 0.53
SLC6A2 P23975 1/20 0.48
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 3/20 0.46
ATM Q13315 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
KCNA3 P22001 1/20 0.46
HTR1B P28222 4/20 0.45
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
POLB P06746 1/20 0.44
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
MCL1 Q07820 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
BCL2 P10415 1/20 0.42
BCL2L1 Q07817 1/20 0.42
BAD Q92934 1/20 0.42

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
Oxalic Acid SCHEMBL9613804 0.89 KMT2A (0.60) KMT2AKDM4EALDH1A1HPGDATM
Oxalic Acid SCHEMBL9614031 0.86 KMT2A (0.52) KMT2ASLC6A2SLC6A4KDM4EALDH1A1
Oxalic Acid SCHEMBL9613773 0.85 KMT2A (0.50) KMT2ASLC6A2SLC6A4KDM4EALDH1A1
Oxalic Acid SCHEMBL9614095 0.84 KMT2A (0.53) KMT2ASLC6A4KDM4EALDH1A1HPGD
SCHEMBL12071826 0.82 HTR1B (0.60) KMT2ASLC6A4KDM4EALDH1A1HPGD
SCHEMBL541161 0.82 HTR1B (0.60) KMT2ASLC6A4KDM4EALDH1A1HPGD
Isophthalic Acid SCHEMBL27276104 0.81 MRGPRX4 (0.56) KMT2AKDM4EALDH1A1HPGDATM
Hydrochloric Acid SCHEMBL28883801 0.81 HTR1B (0.58) KMT2ASLC6A4KDM4EALDH1A1HPGD
Hydrochloric Acid SCHEMBL28370503 0.81 HTR1B (0.58) KMT2ASLC6A4KDM4EALDH1A1HPGD
Oxalic Acid SCHEMBL9613954 0.80 HTR1A (0.46) KMT2AKDM4EALDH1A1ATMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5135947-A Treatment of depression, eating disorders, and alcoholism ELI LILLY AND COMPANY (US) 1992-08-04 US disclosed
EP-0288188-B1 1-PHENYL-3-NAPHTHALENYLOXY-PROPANAMINES ELI LILLY AND COMPANY (US) 1991-10-16 EP disclosed
EP-0288188-A1 1-Phenyl-3-naphthalenyloxy-propanamines ELI LILLY AND COMPANY (US) 1988-10-26 EP disclosed