SCHEMBL26512781

SCHEMBL26512781

CCC1(CC)c2ccccc2-c2c1c1c(c3ccccc23)OC(c2ccc(OC)cc2)(c2nc(-c3ccccc3)cc(-c3ccccc3)n2)C=C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 1/20 0.36
KDM4E B2RXH2 6/20 0.33
HPGD P15428 4/20 0.33
KMT2A Q03164 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
GAA P10253 1/20 0.33
ACP1 P24666 4/20 0.33
BRD4 O60885 1/20 0.33
MAPT P10636 5/20 0.32
ALDH1A1 P00352 3/20 0.32
HTT P42858 2/20 0.32
LMNA P02545 1/20 0.32
AURKA O14965 1/20 0.32
AURKB Q96GD4 1/20 0.32
FLT3 P36888 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
MEN1 O00255 2/20 0.31
TSHR P16473 1/20 0.31
ATM Q13315 1/20 0.31
ACHE P22303 1/20 0.31

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
SCHEMBL26512894 0.94 KDM4E (0.32) ACACAKDM4EHPGDKMT2ATDP1
SCHEMBL26512774 0.93 BRD4 (0.39) ACACAKDM4EHPGDTDP1ACP1
SCHEMBL26512783 0.93 BRD4 (0.39) ACACAKDM4EHPGDTDP1ACP1
SCHEMBL26512791 0.91 ACACA (0.38) ACACAKDM4EHPGDKMT2ATDP1
SCHEMBL26512767 0.91 LMNA (0.32) KMT2AMAPTLMNAMEN1
SCHEMBL26512877 0.90
SCHEMBL26512796 0.90 ACACA (0.35) ACACAKDM4EHPGDKMT2ATDP1
SCHEMBL26512788 0.90 ACACA (0.35) ACACAKDM4EHPGDKMT2ATDP1
SCHEMBL26512802 0.89
SCHEMBL26513004 0.89 ACACA (0.38) ACACAKDM4EHPGDKMT2ATDP1

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