SCHEMBL11523648

SCHEMBL11523648

N#CC(C#N)=Cc1ccc(CN)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.68
ALDH1A1 P00352 8/20 0.68
MAPT P10636 8/20 0.68
MEN1 O00255 7/20 0.68
KDM4E B2RXH2 6/20 0.68
NPSR1 Q6W5P4 3/20 0.68
LMNA P02545 3/20 0.68
POLB P06746 1/20 0.68
THRB P10828 1/20 0.59
CISD1 Q9NZ45 1/20 0.59
EGFR P00533 5/20 0.57
HPGD P15428 4/20 0.52
CYP3A4 P08684 3/20 0.52
TSHR P16473 3/20 0.52
NFKB1 P19838 3/20 0.52
BLM P54132 3/20 0.52
PMP22 Q01453 3/20 0.52
CYP1A2 P05177 2/20 0.52
APEX1 P27695 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.48

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
SCHEMBL17466932 0.82 MAPT (1.00) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL3369340 0.80 KMT2A (0.68) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL11503795 0.80 KMT2A (0.68) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL14388449 0.80 KMT2A (0.68) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL29227377 0.77 KMT2A (0.63) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL11583675 0.77 KMT2A (0.63) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL8721441 0.77 MAPT (0.77) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL17466936 0.76 MAPT (0.85) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL8543974 0.76 KMT2A (0.61) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL9480738 0.76 MEN1 (0.61) KMT2AALDH1A1MAPTMEN1KDM4E

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
US-4158658-A Bichromophoric benzoxazole-styrene ultraviolet stabilizers and their use in organic compositions EASTMAN KODAK COMPANY (US) 1979-06-19 US disclosed
US-4075162-A BICHROMOPHORIC BENZOXAZOLE-STYRENE ULTRAVIOLET STABILIZERS AND THEIR USE IN ORGANIC COMPOSITIONS EASTMAN KODAK COMPANY (US) 1978-02-21 US disclosed