SCHEMBL11326953

SCHEMBL11326953

NNC(=O)Oc1ccccc1C(=O)NN

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 2/20 0.66
KMT2A Q03164 5/20 0.57
MEN1 O00255 3/20 0.57
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
ALDH1A1 P00352 3/20 0.46
STAT3 P40763 1/20 0.45
HCRTR1 O43613 2/20 0.44
HPGD P15428 5/20 0.43
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 3/20 0.43
MAPT P10636 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MITF O75030 1/20 0.43
GAA P10253 1/20 0.43
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
P2RX7 Q99572 1/20 0.42
USP2 O75604 1/20 0.42

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
SCHEMBL7748621 0.87 CTSD (0.68) CTSDKMT2AMEN1CA1CA2
SCHEMBL17479848 0.85 CTSD (0.66) CTSDKMT2AMEN1CA1CA2
SCHEMBL7195412 0.84 ALDH1A1 (0.48) CTSDKMT2AMEN1ALDH1A1HPGD
SCHEMBL12468767 0.84 CTSD (0.69) CTSDKMT2AMEN1CA1CA2
SCHEMBL6329484 0.82 CTSD (0.72) CTSDKMT2AMEN1CA1CA2
SCHEMBL3234187 0.82 CTSD (0.62) CTSDKMT2AMEN1CA1CA2
SCHEMBL2564034 0.81 CTSD (0.70) CTSDKMT2AMEN1CA1CA2
SCHEMBL9825473 0.81 SLC6A3 (0.66) CTSDKMT2AMEN1ALDH1A1HPGD
SCHEMBL28767126 0.81 CTSD (0.65) CTSDKMT2AMEN1CA1CA2
SCHEMBL27548437 0.80 CTSD (0.58) CTSDKMT2AMEN1CA1CA2

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
US-4306930-A INCORPORATING A HYDRAZIDE OR DIHYDRAZIDE AND THEN VULCANIZING IN CONTACT WITH A METAL CIBA-GEIGY CORPORATION (US) 1981-12-22 US disclosed
US-4077948-A N-SALICYLIDENE-N*-SALICYLHYDRAZIDES CIBA-GEIGY CORPORATION (US) 1978-03-07 US disclosed