SCHEMBL5550993

SCHEMBL5550993

COC(=O)c1cc2ccc(OC)cc2c2c1C=CC(c1ccc(N3CCCC3)cc1)(c1ccc(N3CCCC3)cc1)O2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.38
ALDH1A1 P00352 7/20 0.37
KMT2A Q03164 6/20 0.37
RAB9A P51151 3/20 0.37
NR4A1 P22736 1/20 0.37
MCL1 Q07820 1/20 0.37
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
QSOX1 O00391 1/20 0.37
NPC1 O15118 1/20 0.37
PKM P14618 1/20 0.37
MEN1 O00255 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 3/20 0.35
HPGD P15428 3/20 0.35
HTT P42858 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
TSHR P16473 1/20 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
SCHEMBL5549293 0.96 MAPT (0.39) MAPTALDH1A1KMT2ARAB9ANR4A1
SCHEMBL1845080 0.95 KEAP1 (0.38) MAPTALDH1A1KMT2ARAB9ANR4A1
SCHEMBL7970242 0.94 L3MBTL1 (0.37) MAPTALDH1A1KMT2ARAB9ANR4A1
SCHEMBL7971698 0.91 MAPT (0.38) MAPTALDH1A1KMT2ARAB9ANR4A1
SCHEMBL5551024 0.91 KMT2A (0.42) MAPTALDH1A1KMT2ARAB9ASMN1; SMN2
SCHEMBL5645606 0.90 MAPT (0.35) MAPTALDH1A1KMT2ARAB9ANR4A1
SCHEMBL1845404 0.90 KMT2A (0.43) MAPTALDH1A1KMT2ARAB9ASMN1; SMN2
SCHEMBL7970251 0.89 RAB9A (0.33) MAPTALDH1A1KMT2ARAB9ANR4A1
SCHEMBL7784131 0.89 MAPT (0.39) MAPTALDH1A1KMT2ARAB9ANR4A1
SCHEMBL1848196 0.89 PLA2G2A (0.41) MAPTALDH1A1KMT2ALMNASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975619-B1 INTENSE COLOURING PHOTOCHROMIC 2H-NAPHTHO[1,2-b] PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LTD (GB) 2007-01-03 EP disclosed
EP-0975619-B1 INTENSE COLOURING PHOTOCHROMIC 2H-NAPHTHO[1,2-b] PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LTD (GB) 2007-01-03 EP disclosed
EP-0975619-A1 INTENSE COLOURING PHOTOCHROMIC 2$i(H)-NAPHTHO 1,2-$i(b)]PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LIMITED (GB) 2000-02-02 EP disclosed
WO-1998042695-A1 INTENSE COLOURING PHOTOCHROMIC 2H-NAPHTHO[1,2-b]PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LIMITED (GB) 1998-10-01 WO disclosed