SCHEMBL11598535

SCHEMBL11598535

CC(=O)NNc1ccc(N2C(=O)C(=C3Sc4ccccc4N3CCCS(=O)(=O)O)SC2=S)cc1.CCN(CC)CC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 13/20 0.68
▸ KMT2A Q03164 13/20 0.68
▸ HPGD P15428 5/20 0.68
▸ ALOX15 P16050 3/20 0.68
▸ ALOX12 P18054 3/20 0.68
▸ CASP1 P29466 3/20 0.68
▸ HSD17B10 Q99714 3/20 0.68
▸ CASP7 P55210 2/20 0.68
▸ LMNA P02545 1/20 0.68
▸ POLB P06746 9/20 0.67
▸ CTDSP1 Q9GZU7 2/20 0.67
▸ RXFP1 Q9HBX9 1/20 0.67
▸ MAPT P10636 6/20 0.61
▸ MMP13 P45452 4/20 0.61
▸ ALDH1A1 P00352 5/20 0.59
▸ TDP1 Q9NUW8 4/20 0.59
▸ PKM P14618 1/20 0.59
▸ ALPG P10696 2/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.49

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
SCHEMBL11598532 1.00 MEN1 (0.68) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL11594944 0.90 MEN1 (0.67) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL11594949 0.90 MEN1 (0.67) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL10786670 0.81 MEN1 (1.00) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL8863661 0.80 MEN1 (0.86) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL8863662 0.80 MEN1 (0.86) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL9858105 0.76 MEN1 (1.00) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL9858108 0.76 MEN1 (1.00) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL11596193 0.75 MEN1 (0.57) MEN1KMT2AHPGDALOX15ALOX12
SCHEMBL11596191 0.75 MEN1 (0.57) MEN1KMT2AHPGDALOX15ALOX12

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-4080207-A Radiation-sensitive compositions and photographic elements containing N-(acylhydrazinophenyl) thioamide nucleating agents EASTMAN KODAK COMPANY (US) 1978-03-21 — — US claimed
US-4080207-A Radiation-sensitive compositions and photographic elements containing N-(acylhydrazinophenyl) thioamide nucleating agents EASTMAN KODAK COMPANY (US) 1978-03-21 — — US disclosed
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