SCHEMBL1795382

SCHEMBL1795382

O=C(CSc1ccccc1)N(c1ccccc1)c1ccc(N(C(=O)CSc2ccccc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.57
LMNA P02545 3/20 0.56
ALDH1A1 P00352 8/20 0.53
KMT2A Q03164 4/20 0.53
NPSR1 Q6W5P4 2/20 0.53
POLB P06746 2/20 0.53
NPC1 O15118 2/20 0.53
HTT P42858 2/20 0.53
RAB9A P51151 1/20 0.53
MEN1 O00255 3/20 0.43
HPGD P15428 2/20 0.43
MAPT P10636 1/20 0.43
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SIGMAR1 Q99720 1/20 0.42
FKBP1A P62942 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL3776920 0.98 FFAR1 (0.59) FFAR1LMNAALDH1A1KMT2ANPSR1
SCHEMBL3782643 0.80 SIGMAR1 (0.49) FFAR1LMNAALDH1A1KMT2ANPSR1
SCHEMBL1561385 0.74 ALDH1A1 (0.63) ALDH1A1KMT2ANPSR1POLBNPC1
SCHEMBL9389953 0.74 ALDH1A1 (0.63) LMNAALDH1A1KMT2ANPSR1POLB
SCHEMBL74365 0.73 FFAR1 (1.00) FFAR1LMNAALDH1A1KMT2APOLB
SCHEMBL9179407 0.73 FFAR1 (0.74) FFAR1LMNAALDH1A1KMT2APOLB
SCHEMBL30966332 0.73 ALDH1A1 (0.68) ALDH1A1KMT2ANPSR1POLBNPC1
SCHEMBL5992200 0.72 NPC1 (0.65) FFAR1ALDH1A1KMT2ANPC1RAB9A
SCHEMBL10150422 0.71 FFAR1 (0.53) FFAR1LMNAALDH1A1KMT2ANPSR1
SCHEMBL22170060 0.71 ALDH1A1 (0.65) LMNAALDH1A1KMT2ANPSR1POLB

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-7951874-B2 Non-conjugated polymeric perarylated boranes, use thereof as organically semiconductor transmitters and/or transport materials, methods for producing same and uses thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2011-05-31 US disclosed
US-7858724-B2 Polymeric, phosphorescent, organically semi-conductive emitter materials based on perarylated boranes, method for their production and use thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2010-12-28 US disclosed
US-20070191587-A1 Polymeric, phosphorescent, organically semi-conductive emitter materials based on perarylated boranes, method for their production and use thereof OSRAM OLED GMBH (DE) 2007-08-16 US disclosed
US-20060229431-A1 Non-conjugated polymeric perarylated boranes, use thereof as organically semiconductor transmitters and/or transport materials, methods for producing same and uses thereof OSRAM OLED GMBH (DE) 2006-10-12 US disclosed