SCHEMBL14498669

SCHEMBL14498669

CN(C(=O)Nc1cccc(-n2nnnc2S)c1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ IMPDH2 P12268 4/20 0.41
▸ MAPK13 O15264 1/20 0.40
▸ MAPK12 P53778 1/20 0.40
▸ MAPK11 Q15759 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ TDO2 P48775 1/20 0.40
▸ MLYCD O95822 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ LMNA P02545 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
SCHEMBL14498659 0.87 TP53 (0.45) SMN1; SMN2RAB9ANPSR1MAPTPOLB
SCHEMBL13295062 0.86 ALDH1A1 (0.40) SMN1; SMN2RAB9ANPC1NPSR1MAPT
SCHEMBL14498668 0.86 MEN1 (0.55) SMN1; SMN2RAB9ANPC1NPSR1MAPT
SCHEMBL14498648 0.82 TSHR (0.46) SMN1; SMN2RAB9ANPC1MAPTPOLB
SCHEMBL8172135 0.82 ALDH1A1 (0.43) SMN1; SMN2RAB9ANPC1NPSR1MAPT
SCHEMBL10998631 0.82 ALDH1A1 (0.47) SMN1; SMN2RAB9AKDM4ENPSR1MAPT
SCHEMBL29870318 0.81 IDO1 (0.54) RAB9ANPC1MAPTPOLBIDO1
SCHEMBL1537861 0.81 IDO1 (0.54) RAB9ANPC1MAPTPOLBIDO1
SCHEMBL5669641 0.80 POLB (0.54) RAB9ANPC1KDM4EPOLB
SCHEMBL7954313 0.80 IDO1 (0.53) RAB9ANPC1MAPTPOLBIDO1

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 5 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-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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