SCHEMBL26513016

SCHEMBL26513016

COc1ccc(C2(c3ccc(-c4nc(OC)nc(OC)n4)cc3)C=Cc3c4c(c5ccccc5c3O2)-c2ccccc2C4(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP1B1 Q16678 1/20 0.31
SYK P43405 1/20 0.31
S1PR1 P21453 1/20 0.31
NR1H4 Q96RI1 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
NFKB1 P19838 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ADORA3 P0DMS8 1/20 0.30
BRD4 O60885 1/20 0.30
ABCG2 Q9UNQ0 1/20 0.30
ACACA Q13085 1/20 0.30

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
SCHEMBL26512994 0.94 MAPT (0.36) MAPTLMNACYP1A1CYP1A2CYP1B1
SCHEMBL26512649 0.92 TP53 (0.32) MAPTNPC1TP53RAB9ASMN1; SMN2
SCHEMBL26513020 0.91 MAPT (0.34) MAPTLMNACYP1A1CYP1A2CYP1B1
SCHEMBL26513005 0.91 BRD4 (0.41) MAPTLMNACYP1A1CYP1A2CYP1B1
SCHEMBL26513053 0.91 GPR84 (0.36) MAPTLMNACYP1A1CYP1A2CYP1B1
SCHEMBL26513001 0.91 BRD4 (0.41) MAPTLMNACYP1A1CYP1A2CYP1B1
SCHEMBL26513018 0.91 ATM (0.30)
SCHEMBL25604650 0.89 GPR84 (0.34) MAPTLMNAGPR84NPC1RAB9A
SCHEMBL25844403 0.89 GPR84 (0.34) MAPTLMNAGPR84NPC1RAB9A
SCHEMBL26518759 0.89 ENPP1 (0.35) MAPTLMNACYP1A1CYP1A2CYP1B1

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-20230323197-A1 PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE AND SPECTACLES HOYA LENS THAILAND LTD. (TH) 2023-10-12 US disclosed
US-20230323197-A1 PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE AND SPECTACLES HOYA LENS THAILAND LTD. (TH) 2023-10-12 US disclosed