SCHEMBL12112008

SCHEMBL12112008

CCCCCCC(Sc1ccc(N)cc1)Sc1ccc(N)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ CSNK1E P49674 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ ADAM17 P78536 1/20 0.37
▸ LMNA P02545 3/20 0.36
▸ CYP3A4 P08684 3/20 0.36
▸ MAPK1 P28482 3/20 0.36
▸ CYP2D6 P10635 3/20 0.36
▸ TSHR P16473 2/20 0.36
▸ TP53 P04637 2/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ABCB11 O95342 1/20 0.36

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
SCHEMBL12112005 0.93 TSHR (0.38) MAPTALDH1A1NPC1RAB9ALMNA
SCHEMBL12112007 0.85 TSHR (0.41) MAPTALDH1A1NPC1RAB9ACYP3A4
SCHEMBL7241349 0.79 LMNA (0.43) ALDH1A1CSNK1ELMNANPSR1MEN1
SCHEMBL12112006 0.77 TSHR (0.44) MAPTALDH1A1NPC1RAB9ACYP3A4
SCHEMBL24986047 0.72 MAPK1 (0.39) MAPTALDH1A1NPC1RAB9ACYP3A4
SCHEMBL8094053 0.72 CYP19A1 (0.45) MAPTALDH1A1NPC1RAB9ACSNK1E
SCHEMBL8085945 0.72 CYP19A1 (0.45) MAPTALDH1A1NPC1RAB9ACSNK1E
SCHEMBL8085720 0.72 CYP19A1 (0.45) MAPTALDH1A1NPC1RAB9ACSNK1E
SCHEMBL8094576 0.72 CYP19A1 (0.45) MAPTALDH1A1NPC1RAB9ACSNK1E
SCHEMBL11041011 0.72 MAOA (0.50) MAPTALDH1A1NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8053041-B2 Overcoat film composition, color filter substrate, and liquid crystal display element JNC CORPORATION (JP) 2011-11-08 — — US disclosed
US-20080167429-A1 Nanoimprinting composition CHISSO CORPORATION 2008-07-10 — — US disclosed
US-20080003381-A1 Overcoat film composition, color filter substrate, and liquid crystal display element CHISSO CORPORATION 2008-01-03 — — US disclosed
Send feedback