SCHEMBL1105098

SCHEMBL1105098

CCc1cc2c(ccc3sc(/C=C/c4cc5c(ccc6sc(CC)cc65)s4)cc32)s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELE P16581 3/20 0.36
VCAM1 P19320 3/20 0.36
ICAM1 P05362 2/20 0.36
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
SMN1; SMN2 Q16637 6/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
CYP2C9 P11712 2/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP1A2 P05177 1/20 0.33
TMIGD3 P0DMS9 1/20 0.33
ADORA1 P30542 1/20 0.33
HTT P42858 3/20 0.31
TSHR P16473 2/20 0.31

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
SCHEMBL12278072 0.82 SELE (0.41) SELEVCAM1ICAM1MAPK1HSD17B10
SCHEMBL17426227 0.82 SELE (0.41) SELEVCAM1ICAM1MAPK1HSD17B10
SCHEMBL1105113 0.80 MAPT (0.34) HSD17B10LMNAMEN1KMT2AHPGD
SCHEMBL13301129 0.79 ICAM1 (0.31) SELEVCAM1ICAM1
SCHEMBL12269113 0.77 SELE (0.38) SELEVCAM1ICAM1MAPK1HSD17B10
SCHEMBL17795861 0.77 SELE (0.41) SELEVCAM1ICAM1MAPK1HSD17B10
SCHEMBL1105109 0.75 ALDH1A1 (0.41) HSD17B10RAB9AMEN1KMT2AALDH1A1
SCHEMBL1105110 0.74 TUBB4A (0.30)
SCHEMBL19363669 0.74 SELE (0.39) SELEVCAM1ICAM1MAPK1HSD17B10
SCHEMBL1105104 0.74 MAPT (0.40) SELEVCAM1ICAM1MAPK1HSD17B10

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-8154014-B2 Organic thin film transistor and organic thin film light-emitting transistor IDEMITSU KOSAN, CO., LTD. (JP) 2012-04-10 US disclosed
US-8154014-B2 Organic thin film transistor and organic thin film light-emitting transistor IDEMITSU KOSAN, CO., LTD. (JP) 2012-04-10 US disclosed
US-20100244000-A1 ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM LIGHT-EMITTING TRANSISTOR IDEMITSU KOSAN CO., LTD. (JP) 2010-09-30 US disclosed
US-20100244000-A1 ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM LIGHT-EMITTING TRANSISTOR IDEMITSU KOSAN CO., LTD. (JP) 2010-09-30 US disclosed