SCHEMBL3446308

SCHEMBL3446308

Nc1ccc(-n2nc(-c3ccccc3)cc2-c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.64
RAB9A P51151 6/20 0.64
SMN1; SMN2 Q16637 5/20 0.64
MEN1 O00255 5/20 0.64
KMT2A Q03164 5/20 0.64
TSHR P16473 2/20 0.64
GFER P55789 1/20 0.64
CYP2C9 P11712 1/20 0.58
USP8 P40818 1/20 0.56
MAPT P10636 7/20 0.53
NPC1 O15118 5/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
LMNA P02545 3/20 0.53
MMP2 P08253 1/20 0.51
KDM4E B2RXH2 3/20 0.49
STAT1 P42224 1/20 0.49
MAPK1 P28482 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
GAA P10253 2/20 0.48
HPGD P15428 3/20 0.47

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
SCHEMBL8291638 0.91 SMN1; SMN2 (0.63) ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL16432877 0.88 CYP2C9 (0.62) ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL10038494 0.88 CYP2C9 (0.62) ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL1198398 0.88 RAB9A (0.65) ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL8120182 0.87 CYP2C9 (0.80) CYP2C9MMP2PTGS1PTGS2
SCHEMBL3852411 0.86 RAB9A (0.62) ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL3857283 0.84 RAB9A (0.61) ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL8297120 0.84 SMN1; SMN2 (0.75) ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL24157480 0.83 CYP2C9 (0.73) ALDH1A1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL2816383 0.83 USP8 (0.76) ALDH1A1RAB9ACYP2C9USP8MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816020-B2 Organic electroluminescent device NIPPON STEEL CHEMICAL CO., LTD. (JP) 2010-10-19 US disclosed
US-7816020-B2 Organic electroluminescent device NIPPON STEEL CHEMICAL CO., LTD. (JP) 2010-10-19 US disclosed
US-7816020-B2 Organic electroluminescent device NIPPON STEEL CHEMICAL CO., LTD. (JP) 2010-10-19 US disclosed
CN-100505965-C Organic electroluminescent element NIPPON STEEL CHEMICAL CO (JP) 2009-06-24 CN disclosed
US-20080093984-A1 Organic Electroluminescent Device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2008-04-24 US disclosed
US-20080093984-A1 Organic Electroluminescent Device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2008-04-24 US disclosed
US-20080093984-A1 Organic Electroluminescent Device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2008-04-24 US disclosed
CN-101065995-A Organic electroluminescence device NIPPON STEEL CHEMICAL CO (JP) 2007-10-31 CN disclosed