SCHEMBL6619474

SCHEMBL6619474

CCOC(=O)COC(=O)c1cc(O)c2ccc(C)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.47
CA12 O43570 3/20 0.46
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA7 P43166 3/20 0.46
CA9 Q16790 3/20 0.46
CA14 Q9ULX7 3/20 0.46
PTPN11 Q06124 2/20 0.45
NLRP3 Q96P20 1/20 0.45
TYR P14679 1/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 1/20 0.40
NPC1 O15118 1/20 0.40
HSD17B2 P37059 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
SCHEMBL13057633 0.90 BCL2L1 (0.56) BCL2L1CA12CA1CA2CA7
SCHEMBL16479443 0.78 CA12 (0.58) BCL2L1CA12CA1CA2CA7
SCHEMBL13057648 0.77 BCL2L1 (0.50) BCL2L1CA12CA1CA2CA7
SCHEMBL30299154 0.77 BCL2L1 (0.53) BCL2L1CA12CA1CA2CA7
SCHEMBL4395647 0.77 LMNA (0.55) BCL2L1CA12CA1CA2CA7
SCHEMBL2932838 0.77 BCL2L1 (0.53) BCL2L1CA12CA1CA2CA7
SCHEMBL2805615 0.77 BCL2L1 (0.53) BCL2L1CA12CA1CA2CA7
SCHEMBL30299161 0.77 BCL2L1 (0.53) BCL2L1CA12CA1CA2CA7
SCHEMBL16474353 0.76 BCL2L1 (0.52) BCL2L1CA12CA1CA2CA7
SCHEMBL3771693 0.76 BCL2L1 (0.56) BCL2L1CA12CA1CA2CA7

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-1036077-B1 PHOTOCHROMIC PYRANO-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 2004-02-04 EP disclosed
EP-1036077-A1 PHOTOCHROMIC PYRANO-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 2000-09-20 EP disclosed
US-6106744-A HAVING A SUBSTITUTED OR UNSUBSTITUTED ?S? PYRAN RING, THE 3,4 POSITIONS OF WHICH ARE FUSED TO THE F SIDE OF THE NAPHTHO PORTION OF THE NAPHTHOPYRAN, AND CERTAIN SUBSTITUENTS AT THE 2-POSITION OF THE ?T? PYRAN RING. PPG INDUSTRIES OHIO, INC. (US) 2000-08-22 US disclosed
WO-1999028323-A1 NOVEL PHOTOCHROMIC PYRANO-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 1999-06-10 WO disclosed