SCHEMBL8943957

SCHEMBL8943957

COc1ccc(N(c2ccc(OC)cc2)c2ccc(C(C)(C)c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA12 O43570 1/20 0.46
CA14 Q9ULX7 1/20 0.46
AOC3 Q16853 1/20 0.43
SLC2A1 P11166 1/20 0.41
MAPT P10636 5/20 0.41
HDAC6 Q9UBN7 1/20 0.40
ALDH1A1 P00352 4/20 0.40
TDP1 Q9NUW8 4/20 0.40
MAPK1 P28482 3/20 0.40
HSD17B10 Q99714 2/20 0.40
RECQL P46063 2/20 0.40
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.40
APEX1 P27695 1/20 0.40
ACHE P22303 1/20 0.39
ENPP2 Q13822 1/20 0.39

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
SCHEMBL22015331 0.93 SMN1; SMN2 (0.46) CA1CA2CA7CA9CA12
SCHEMBL22014956 0.91 KMT2A (0.43) CA1CA2CA7CA9CA12
SCHEMBL15165418 0.88 ACHE (0.48) AOC3MAPTALDH1A1HSD17B10LMNA
SCHEMBL2210124 0.88 SMN1; SMN2 (0.43) ALDH1A1TDP1LMNACYP3A4ESR1
SCHEMBL25986528 0.87 CA1 (0.61) CA1CA2CA7CA9CA12
SCHEMBL10112753 0.87 CA1 (0.61) CA1CA2CA7CA9CA12
SCHEMBL83852 0.87 CA1 (0.61) CA1CA2CA7CA9CA12
SCHEMBL1573622 0.84 CA1 (0.65) CA1CA2CA7CA9CA12
SCHEMBL6233100 0.84 CA1 (0.65) CA1CA2CA7CA9CA12
SCHEMBL23866680 0.82 MAPT (0.49) CA1CA2CA7CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed