SCHEMBL6172997

SCHEMBL6172997

COC(=O)c1c2c(c3cc(OC)ccc3c1C)OC(c1ccccc1)(c1ccc(OC)cc1)C=C2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.38
L3MBTL1 Q9Y468 4/20 0.36
ATM Q13315 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 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
SCHEMBL5178231 0.96 L3MBTL1 (0.38) PLA2G2AL3MBTL1ATMTDP1MEN1
SCHEMBL8978512 0.91 ATM (0.41) L3MBTL1ATMTDP1MEN1KMT2A
SCHEMBL5101722 0.90 KDM4E (0.36) L3MBTL1TDP1MEN1KMT2AKDM4E
SCHEMBL5094512 0.89 AKR1C3 (0.39) PLA2G2AMEN1KMT2AKDM4EALDH1A1
SCHEMBL5107921 0.88 L3MBTL1 (0.40) PLA2G2AL3MBTL1ATMTDP1MEN1
SCHEMBL1331988 0.88 MAPT (0.36) PLA2G2AL3MBTL1TDP1MEN1KMT2A
SCHEMBL30914186 0.88 MAPT (0.36) PLA2G2AL3MBTL1TDP1MEN1KMT2A
SCHEMBL10102254 0.88 ATM (0.39) L3MBTL1ATMTDP1MEN1KMT2A
SCHEMBL5107968 0.87 MAPK8 (0.41) PLA2G2AL3MBTL1ATMTDP1MEN1
SCHEMBL6132018 0.87 L3MBTL1 (0.41) L3MBTL1ATMTDP1MEN1KMT2A

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
EP-1112263-B1 POLYMERIZABLE POLYALKOXYLATED NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 2005-06-08 EP disclosed
US-6113814-A PHOTOCHROMIC; END-CAPPED WITH A POLYMERIZABLE GROUP. TRANSITIONS OPTICAL, INC. (US) 2000-09-05 US disclosed