SCHEMBL7067243

SCHEMBL7067243

CC(C)(C)c1ccc(Oc2cc3c(cc2[N+](=O)[O-])oc(=O)n3Cc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 7/20 0.45
▸ CD74 P04233 4/20 0.45
▸ NPC1 O15118 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ IDO1 P14902 2/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ TP53 P04637 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
SCHEMBL7069590 0.86 MIF (0.46) MIFCD74NPC1ALDH1A1IDO1
SCHEMBL7067342 0.76 IDO1 (0.55) MIFCD74NPC1IDO1MEN1
SCHEMBL7597100 0.71 ALDH1A1 (0.56) NPC1ALDH1A1HPGDNPSR1MEN1
SCHEMBL17886629 0.69 MIF (0.64) MIFCD74NPC1IDO1MEN1
SCHEMBL18171790 0.69 IDO1 (0.79) MIFCD74NPC1IDO1MEN1
SCHEMBL30806471 0.69 IDO1 (0.64) MIFCD74NPC1ALDH1A1IDO1
SCHEMBL24346159 0.68 HTR6 (0.54) NPC1ALDH1A1HPGDNPSR1MEN1
SCHEMBL16565537 0.68 MIF (0.76) MIFCD74MEN1KMT2APOLB
SCHEMBL31451497 0.67 KMT2A (0.61) MIFCD74ALDH1A1IDO1KMT2A
SCHEMBL10825112 0.66 PDE7A (0.68) ALDH1A1HPGDNPSR1MEN1KMT2A

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
EP-1316550-A1 6-Acylamino-5-substituted-benzoxazol-2-one compounds and method for using them EASTMAN KODAK COMPANY (US) 2003-06-04 — — EP disclosed
US-6515176-B1 Disclosed is a 6-acylamino-5-substituted-benzoxazol-2-one compound having the structural formula I: Also disclosed is a method for forming a cyan dye-forming coupler from the above compound. The method and intermediate with a simplified EASTMAN KODAK COMPANY 2003-02-04 — — US disclosed
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