SCHEMBL25255271

SCHEMBL25255271

O=Cc1c(C(=O)O)ccc2c(C(=O)O)cccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
PTPN1 P18031 1/20 0.43
ALOX15 P16050 2/20 0.41
ALDH1A1 P00352 1/20 0.41
PADI4 Q9UM07 1/20 0.41
PRNP P04156 1/20 0.41
TYMS P04818 1/20 0.41
CDC25B P30305 2/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
WDR5 P61964 1/20 0.39
KDM4E B2RXH2 3/20 0.38
TSHR P16473 2/20 0.38
LDHA P00338 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38

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
SCHEMBL7828026 0.86 ERN1 (0.51) NR4A1NR4A2NR4A3PTPN1ALDH1A1
SCHEMBL11718261 0.82 ALDH1A1 (0.55) NR4A1NR4A2NR4A3ALOX15ALDH1A1
Benzene SCHEMBL28172839 0.82 ALDH1A1 (0.55) NR4A1NR4A2NR4A3ALOX15ALDH1A1
SCHEMBL11857852 0.80 NR4A1 (0.67) NR4A1NR4A2NR4A3PTPN1ALOX15
SCHEMBL10012443 0.80 NR4A1 (0.67) NR4A1NR4A2NR4A3PTPN1ALOX15
SCHEMBL10397600 0.80 NR4A1 (0.74) NR4A1NR4A2NR4A3PTPN1ALOX15
SCHEMBL29406795 0.79 NR4A1 (0.73) NR4A1NR4A2NR4A3PTPN1ALOX15
SCHEMBL27985 0.79 NR4A1 (0.73) NR4A1NR4A2NR4A3PTPN1ALOX15
SCHEMBL25256056 0.79 HSD17B10 (0.52) NR4A1NR4A2NR4A3ALOX15ALDH1A1
SCHEMBL547877 0.78 WDR5 (0.61) NR4A1NR4A2NR4A3ALDH1A1CDC25B

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
EP-3872112-B1 HIGHLY BIO-BASED POLYCARBONATE ESTER AND METHOD FOR PRODUCING SAME SK CHEMICALS CO LTD (KR) 2023-07-19 EP claimed