SCHEMBL11689325

SCHEMBL11689325

Nc1ccc(Nc2ccc(N=C3C=CC(=O)C=C3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ ALOX12 P18054 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ TXNRD1 Q16881 1/20 0.41
▸ TXNRD3 Q86VQ6 1/20 0.41
▸ TXNRD2 Q9NNW7 1/20 0.41
▸ RAD52 P43351 1/20 0.40
▸ ENPP2 Q13822 1/20 0.38
▸ NR4A1 P22736 1/20 0.38
▸ ADRA2A P08913 1/20 0.36
▸ ADRA2B P18089 1/20 0.36
▸ ADRA2C P18825 1/20 0.36
▸ TDP1 Q9NUW8 4/20 0.35
▸ HSD17B10 Q99714 2/20 0.35

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
SCHEMBL12747007 0.91 MAPT (0.50) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL14435905 0.89 TXNRD1 (0.48) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL11689083 0.84 ALDH1A1 (0.53) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL28230071 0.84 MAPT (0.59) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL15489199 0.84 MAPT (0.64) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL19427098 0.84 MAPT (0.64) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL9126691 0.84 MAPT (0.59) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL15497987 0.83 MAPT (0.42) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL14594147 0.83 ACHE (0.45) MAPTL3MBTL1ALDH1A1CYP3A4HTT
SCHEMBL11687271 0.83 TXNRD1 (0.49) MAPTL3MBTL1ALDH1A1CYP3A4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4025463-A LINEAR POLYANILINE COMPOUNDS, ANTISTATIC FILMS AND FIBERS EASTMAN KODAK COMPANY (US) 1977-05-24 — — US disclosed
US-4025691-A BENZOQUINONE IMINES EASTMAN KODAK COMPANY (US) 1977-05-24 — — US disclosed
US-4025342-A AMINE SALTS OF LINEAR POLYANILINE COMPOUNDS EASTMAN KODAK COMPANY (US) 1977-05-24 — — US disclosed
US-4025704-A BENZOQUINONE IMINES EASTMAN KODAK COMPANY (US) 1977-05-24 — — US disclosed
US-3963498-A Silver halide element containing an organic semiconductor EASTMAN KODAK COMPANY (US) 1976-06-15 — — US disclosed
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