SCHEMBL14498637

SCHEMBL14498637

CCNC(=O)Nc1cccc(-n2nnnc2S)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.44
▸ LMNA P02545 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ CRHBP P24387 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ CRHR2 Q13324 1/20 0.44
▸ CDK8 P49336 1/20 0.41
▸ BRD4 O60885 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ FGFR3 P22607 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ TDO2 P48775 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MTNR1B P49286 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
SCHEMBL14498639 0.91 MAPT (0.53) ALDH1A1LMNAMAPTL3MBTL1CRHBP
SCHEMBL14498660 0.87 EPHX1 (0.57) ALDH1A1
SCHEMBL1336437 0.86 ALDH1A1 (0.41) ALDH1A1LMNAMAPTL3MBTL1CRHBP
SCHEMBL14093921 0.86 MAPT (0.39) ALDH1A1LMNAMAPTL3MBTL1CRHBP
SCHEMBL14498626 0.85 ALDH1A1 (0.58) ALDH1A1LMNAMAPTL3MBTL1CRHBP
SCHEMBL14498670 0.85 GAA (0.41) ALDH1A1LMNAMAPTL3MBTL1CRHBP
SCHEMBL13297731 0.85 ALDH1A1 (0.40) ALDH1A1LMNAMAPTL3MBTL1CRHBP
SCHEMBL14498648 0.85 TSHR (0.46) LMNAMAPTRAB9ATP53KDR
SCHEMBL14498663 0.84 SMN1; SMN2 (0.51) ALDH1A1LMNAMAPTL3MBTL1RAB9A
SCHEMBL14360486 0.84 EPHX1 (0.40) ALDH1A1LMNAMAPTL3MBTL1CRHBP

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 6 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
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