SCHEMBL11036686

SCHEMBL11036686

Cc1cc(N=Nc2ccc(N(C)C)cc2)ccc1/N=N/c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 6/20 0.68
TDP1 Q9NUW8 5/20 0.68
ALDH1A1 P00352 4/20 0.68
TSHR P16473 2/20 0.68
HSD17B10 Q99714 1/20 0.68
NPC1 O15118 10/20 0.61
RAB9A P51151 9/20 0.61
KMT2A Q03164 8/20 0.61
MEN1 O00255 7/20 0.61
CASP3 P42574 2/20 0.61
SENP8 Q96LD8 2/20 0.61
SENP7 Q9BQF6 2/20 0.61
SENP6 Q9GZR1 2/20 0.61
NSD2 O96028 1/20 0.61
MAPT P10636 6/20 0.56
L3MBTL1 Q9Y468 4/20 0.56
ATM Q13315 1/20 0.56
ALPL P05186 1/20 0.55
ALPI P09923 1/20 0.55
ALPG P10696 1/20 0.55

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
SCHEMBL11048731 0.93 NPC1 (0.59) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL11048726 0.93 NPC1 (0.59) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL11048735 0.93 NPC1 (0.59) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL327807 0.92 NPC1 (0.58) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL12471025 0.92 TDP1 (0.65) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL1614771 0.90 TDP1 (0.61) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL1614770 0.90 TDP1 (0.61) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL30569593 0.90 TDP1 (0.61) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL14866700 0.89 NPC1 (0.58) MAPK1TDP1ALDH1A1TSHRHSD17B10
SCHEMBL3437396 0.89 NPC1 (0.58) MAPK1TDP1ALDH1A1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0099014-A3 DARK COLOURED COMPOSITION BASED ON LIQUID CRYSTALS ASULAB S.A. (CH) 1984-12-12 EP disclosed
EP-0099014-A2 Dark coloured composition based on liquid crystals ASULAB S.A. (CH) 1984-01-25 EP disclosed