SCHEMBL8943468

SCHEMBL8943468

O=C(O)c1cc[c]c(-c2cc(C(=O)O)cc(C(=O)O)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.41
DHODH Q02127 3/20 0.41
KEAP1 Q14145 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
PKM P14618 1/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA9 Q16790 3/20 0.36
CA7 P43166 2/20 0.36
CA14 Q9ULX7 2/20 0.36
CA6 P23280 2/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
CA4 P22748 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL6800007 0.85 KMO (0.56) KMOKEAP1L3MBTL1RXRARXRB
SCHEMBL7150692 0.85 KMO (0.50) KMODHODHKEAP1RXRARXRB
SCHEMBL490251 0.71 KDM4E (0.42) KMOL3MBTL1CA12CA1CA2
SCHEMBL2467941 0.71 CA12 (0.46) KMOL3MBTL1CA12CA1CA2
SCHEMBL5857066 0.71 KDM4E (0.42) KMOL3MBTL1CA12CA1CA2
SCHEMBL145349 0.71 DHODH (0.58) KMODHODHRXRARXRBCA12
SCHEMBL444146 0.69 GABRP (0.44) KMOL3MBTL1CA12CA1CA2
SCHEMBL142939 0.69 TSHR (0.40) KMOL3MBTL1CA12CA1CA2
SCHEMBL1205901 0.69 TSHR (0.48) L3MBTL1RXRARXRBCA12CA1
SCHEMBL753676 0.69 ALDH1A1 (0.43) L3MBTL1RXRARXRBCA12CA1

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
US-5534403-A BENZOXAZOLE CARBOCYANINE SENSITIZING DYES, STORAGE STABILITY FUJI PHOTO FILM CO., LTD. (JP) 1996-07-09 US disclosed