SCHEMBL18806593

SCHEMBL18806593

CC(=O)c1ccc(N=Nc2ccc(N)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 1.00
▸ RAB9A P51151 6/20 1.00
▸ NPC1 O15118 4/20 1.00
▸ MAPK1 P28482 2/20 0.68
▸ SMN1; SMN2 Q16637 2/20 0.68
▸ TDP1 Q9NUW8 2/20 0.68
▸ STAT3 P40763 1/20 0.68
▸ STAT1 P42224 1/20 0.68
▸ KDM4E B2RXH2 1/20 0.61
▸ NOS3 P29474 3/20 0.59
▸ NOS1 P29475 3/20 0.59
▸ KMT2A Q03164 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ L3MBTL1 Q9Y468 2/20 0.58
▸ CYP1A1 P04798 2/20 0.55
▸ CYP1B1 Q16678 1/20 0.55
▸ PKM P14618 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ CA2 P00918 2/20 0.47
▸ CA12 O43570 1/20 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
SCHEMBL18806585 1.00 MAPT (1.00) MAPTRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL18806554 1.00 MAPT (1.00) MAPTRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL14336603 0.89 MAPT (0.83) MAPTRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL29042753 0.89 MAPT (0.83) MAPTRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL18806562 0.89 MAPT (0.83) MAPTRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL223335 0.87 MAPT (0.75) MAPTRAB9ANPC1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL4289450 0.84 MAPT (0.72) MAPTRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL11646587 0.84 MAPT (0.72) MAPTRAB9ANPC1MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL4372451 0.84 MAPT (0.72) MAPTRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL28423902 0.82 MAPT (0.69) MAPTRAB9ANPC1MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10731078-B2 Composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-08-04 — — US disclosed
US-10023743-B2 Dichroic pigment compounds and compositions containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-07-17 — — US disclosed
US-10023743-B2 Dichroic pigment compounds and compositions containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-07-17 — — US disclosed
US-10005960-B2 Composition and polarizing film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-06-26 — — US disclosed
US-20180037739-A1 COMPOUND AND COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-08 — — US disclosed
US-20180037739-A1 COMPOUND AND COMPOSITION CONTAINING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-08 — — US disclosed
US-20180030354-A1 COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 — — US disclosed
US-20180030354-A1 COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 — — US disclosed
US-20170121605-A1 COMPOSITION AND POLARIZING FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-05-04 — — US disclosed
US-20170121605-A1 COMPOSITION AND POLARIZING FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-05-04 — — US disclosed
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