SCHEMBL16768529

SCHEMBL16768529

Cc1ccc(-c2sc(-c3ccc(C)cc3)c3c4ccncc4c4cnccc4c23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 2/20 0.38
LMNA P02545 2/20 0.38
XBP1 P17861 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ACHE P22303 1/20 0.37
ALDH1A1 P00352 3/20 0.36
ALOX5 P09917 4/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL16768524 0.85 ACHE (0.36) KDM4ESMN1; SMN2MAPTMAPK1LMNA
SCHEMBL16768526 0.83 NOTUM (0.42) KDM4ESMN1; SMN2MAPTCYP1A2CYP3A4
SCHEMBL16768527 0.82 TNF (0.43) KDM4ESMN1; SMN2MAPTCYP1A2CYP3A4
SCHEMBL16768522 0.82 KIF11 (0.49) KDM4ESMN1; SMN2MAPTLMNANPSR1
SCHEMBL10415807 0.79 KDM4E (0.46) KDM4ESMN1; SMN2MAPTLMNACYP1A2
SCHEMBL16768537 0.75 CYP3A4 (0.36) KDM4ESMN1; SMN2MAPTMAPK1LMNA
SCHEMBL16768519 0.74 CYP11B1 (0.49) KDM4ESMN1; SMN2CYP1A2NPC1RAB9A
SCHEMBL16768530 0.72 TNF (0.41) ALOX5
SCHEMBL16768520 0.71 ALDH1A1 (0.41) KDM4ESMN1; SMN2MAPTNPSR1ACHE
SCHEMBL16768550 0.70 TNF (0.34) KDM4EMAPTCYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9666809-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 US disclosed
US-9666809-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-30 US disclosed
US-20150155497-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-04 US disclosed
US-20150155497-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-04 US disclosed