Oxalic Acid

Oxalic Acid

SCHEMBL9005359

N#Cc1cccc(N2CCC2CN)n1.O=C(O)C(=O)O

nearest known ligand 0.43

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 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.43
PTPN11 Q06124 2/20 0.41
DRD4 P21917 2/20 0.40
CTSS P25774 3/20 0.38
HTR1A P08908 1/20 0.37
DRD2 P14416 1/20 0.37
USP30 Q70CQ3 2/20 0.36
PIM1 P11309 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
LCAT P04180 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
ACACB O00763 1/20 0.34

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
SCHEMBL7391156 0.92 CTSS (0.40) MGLLPTPN11DRD4CTSSHTR1A
Hydrochloric Acid SCHEMBL9005437 0.91 CTSS (0.39) MGLLPTPN11DRD4CTSSHTR1A
Oxalic Acid SCHEMBL9005357 0.78 PRKCQ (0.48) MGLLCTSSPIM1JAK2JAK1
SCHEMBL7391630 0.77 PTPN11 (0.50) PTPN11PIM1
Oxalic Acid SCHEMBL9005348 0.74 CTSS (0.51) CTSSPIM1LCATIRAK4
SCHEMBL7391751 0.70 HSD11B1 (0.42) PTPN11PIM1HCRTR1HCRTR2ACACB
Hydrochloric Acid SCHEMBL9005386 0.69 HSD11B1 (0.41) PTPN11PIM1HCRTR1HCRTR2ACACB
SCHEMBL7391155 0.68 PRKCQ (0.45) CTSSPIM1IRAK4
SCHEMBL7392572 0.67 HTR3E (0.50) PTPN11PIM1ACACB
Hydrochloric Acid SCHEMBL9005436 0.67 PRKCQ (0.44) CTSSPIM1IRAK4

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-5576320-A 1-heteruarylazetidines and -pyrrolidines, process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1996-11-19 US disclosed
US-5565474-A 1-heteroarylazetidines and -pyrrolidines process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1996-10-15 US disclosed
US-5410057-A 1-heteroarylazetidines and -pyrrolidines SANOFI (FR) 1995-04-25 US disclosed