SCHEMBL32889301

SCHEMBL32889301

Cc1c(C(=O)O)nnn1-c1ccc(C(=O)O)cc1

nearest known ligand 0.82

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.82
HTT P42858 2/20 0.76
TP53 P04637 2/20 0.64
CA2 P00918 5/20 0.61
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
POLB P06746 2/20 0.53
ALOX12 P18054 1/20 0.52
CA1 P00915 4/20 0.51
CA12 O43570 2/20 0.51
CA9 Q16790 2/20 0.51
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.47
APEX1 P27695 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL2553499 0.90 PTGS2 (0.78) PTGS2HTTTP53CA2KMT2A
SCHEMBL20604184 0.88 HTT (0.78) PTGS2HTTTP53CA2KMT2A
SCHEMBL4771303 0.86 HTT (1.00) PTGS2HTTTP53CA2KMT2A
SCHEMBL17260096 0.85 PTGS2 (0.77) PTGS2HTTTP53CA2KMT2A
SCHEMBL3402693 0.85 PTGS2 (0.77) PTGS2HTTTP53CA2KMT2A
SCHEMBL16697767 0.85 HTT (0.73) PTGS2HTTTP53CA2KMT2A
SCHEMBL13158528 0.83 HTT (0.61) PTGS2HTTTP53CA2KMT2A
SCHEMBL15882034 0.83 HTT (0.69) PTGS2HTTTP53CA2KMT2A
SCHEMBL3400920 0.77 HTT (0.61) PTGS2HTTTP53CA2KMT2A
SCHEMBL28675386 0.77 HTT (0.61) PTGS2HTTTP53CA2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121755279-A Catalyst for synthesizing cyclic carbonate and preparation method thereof 中国石油化工股份有限公司 2026-03-31 CN disclosed