SCHEMBL10998631

SCHEMBL10998631

CCN(CC)C(=O)Nc1cccc(-n2nnnc2S)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ CA12 O43570 2/20 0.47
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ CA9 Q16790 2/20 0.47
▸ RAB9A P51151 4/20 0.43
▸ LMNA P02545 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ POLB P06746 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAOA P21397 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CDC7 O00311 1/20 0.39

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
SCHEMBL14498659 0.87 TP53 (0.45) ALDH1A1RAB9ALMNAMAPTL3MBTL1
SCHEMBL14498668 0.86 MEN1 (0.55) ALDH1A1HSD17B10HPGDRAB9ALMNA
SCHEMBL13295062 0.86 ALDH1A1 (0.40) ALDH1A1HPGDRAB9ALMNAMAPT
SCHEMBL14498626 0.84 ALDH1A1 (0.58) ALDH1A1RAB9ALMNAMAPTL3MBTL1
SCHEMBL29870318 0.83 IDO1 (0.54) ALDH1A1HSD17B10HPGDRAB9ALMNA
SCHEMBL1537861 0.83 IDO1 (0.54) ALDH1A1HSD17B10HPGDRAB9ALMNA
SCHEMBL14498637 0.82 ALDH1A1 (0.44) ALDH1A1RAB9ALMNAMAPTL3MBTL1
SCHEMBL28026468 0.82 ALDH1A1 (0.46) ALDH1A1HPGDRAB9ALMNAMAPT
SCHEMBL9769965 0.82 ALDH1A1 (0.48) ALDH1A1HPGDRAB9ALMNAMAPT
SCHEMBL14498669 0.82 SMN1; SMN2 (0.45) ALDH1A1HSD17B10KDM4ERAB9ALMNA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7235352-B2 Photothermographic material FUJIFILM CORPORATION (JP) 2007-06-26 — — US disclosed
US-7235352-B2 Photothermographic material FUJIFILM CORPORATION (JP) 2007-06-26 — — US disclosed
US-20070117054-A1 Photothermographic material FUJI PHOTO FILM CO., LTD. 2007-05-24 — — US disclosed
US-20070117054-A1 Photothermographic material FUJI PHOTO FILM CO., LTD. 2007-05-24 — — US disclosed
US-7211373-B2 Photothermographic material FUJIFILM CORPORATION (JP) 2007-05-01 — — US disclosed
US-7211373-B2 Photothermographic material FUJIFILM CORPORATION (JP) 2007-05-01 — — US disclosed
US-4508816-A USING PERSULFATE FUJI PHOTO FILM CO., LTD. (JP) 1985-04-02 — — US disclosed
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