Oxalic Acid

Oxalic Acid

SCHEMBL5863159

CN(C)CCNC(=O)c1ccc(-c2ccc(CSCCOc3ccccc3)cc2)cc1.O=C(O)C(=O)O

nearest known ligand 0.51

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
ALDH1A1 P00352 4/20 0.51
ALOX5 P09917 1/20 0.50
LMNA P02545 4/20 0.49
SMN1; SMN2 Q16637 8/20 0.48
NPC1 O15118 7/20 0.47
RAB9A P51151 6/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
HPGD P15428 1/20 0.47
POLB P06746 1/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
HTT P42858 2/20 0.46
ROCK2 O75116 2/20 0.46
ROCK1 Q13464 2/20 0.46
MAPT P10636 2/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
FYN P06241 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
Oxalic Acid SCHEMBL5863058 0.93 ROCK2 (0.48) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
Oxalic Acid SCHEMBL5863295 0.92 FYN (0.47) ALOX5LMNASMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL5863069 0.91 ROCK2 (0.49) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL5863380 0.89 ROCK2 (0.50) ALDH1A1ALOX5LMNASMN1; SMN2NPC1
SCHEMBL5863110 0.89 FYN (0.48) ALDH1A1ALOX5LMNASMN1; SMN2NPC1
Oxalic Acid SCHEMBL5863493 0.87 KDM4E (0.45) ALDH1A1ALOX5LMNASMN1; SMN2NPC1
Oxalic Acid SCHEMBL5863123 0.86 CYP3A4 (0.51) ALDH1A1SMN1; SMN2NPC1RAB9AMEN1
Oxalic Acid SCHEMBL5863207 0.86 FYN (0.49) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
Oxalic Acid SCHEMBL5863422 0.85 CYP3A4 (0.51) ALDH1A1SMN1; SMN2NPC1RAB9AMEN1
Oxalic Acid SCHEMBL5863223 0.85 KDR (0.47) ALDH1A1LMNASMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7132456-B2 MCH receptor antagonists ELI LILLY AND COMPANY (US) 2006-11-07 US disclosed
US-20060052449-A1 Novel mch receptor antagonists ELI LILLY AND COMPANY 2006-03-09 US 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-20060052449-A1 Novel mch receptor antagonists MCHR1, MCHR2, MC1R ALDH1A1 1500/4885ALOX5 3485/4885LMNA 3678/4885

“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.