SCHEMBL26512796

SCHEMBL26512796

CCC1(CC)c2ccccc2-c2c1c1c(c3ccccc23)OC(c2ccc(OC)cc2)(c2cc(-c3ccccc3)cc(-c3ccccc3)n2)C=C1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 1/20 0.35
MAPT P10636 5/20 0.32
KDM4E B2RXH2 4/20 0.32
HPGD P15428 4/20 0.32
ALDH1A1 P00352 3/20 0.32
KMT2A Q03164 2/20 0.32
LTB4R Q15722 2/20 0.31
ACP1 P24666 2/20 0.31
HTT P42858 2/20 0.31
LMNA P02545 1/20 0.31
AURKA O14965 1/20 0.31
AURKB Q96GD4 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
GAA P10253 1/20 0.31
FLT3 P36888 1/20 0.31
MCL1 Q07820 1/20 0.30
TP53 P04637 1/20 0.30
GPR84 Q9NQS5 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
SCHEMBL26512902 0.94 KDM4E (0.31) ACACAMAPTKDM4EHPGDALDH1A1
SCHEMBL26512791 0.94 ACACA (0.38) ACACAMAPTKDM4EHPGDALDH1A1
SCHEMBL26512788 0.92 ACACA (0.35) ACACAMAPTKDM4EHPGDALDH1A1
SCHEMBL26513013 0.90 ACACA (0.36) ACACAMAPTKDM4EHPGDALDH1A1
SCHEMBL26512781 0.90 ACACA (0.36) ACACAMAPTKDM4EHPGDALDH1A1
SCHEMBL26512783 0.89 BRD4 (0.39) ACACAMAPTKDM4EHPGDALDH1A1
SCHEMBL26512774 0.89 BRD4 (0.39) ACACAMAPTKDM4EHPGDALDH1A1
SCHEMBL26512899 0.88 KDM4E (0.36) ACACAMAPTKDM4EHPGDALDH1A1
SCHEMBL25600636 0.86 HTT (0.30) HTTGPR84
SCHEMBL26627989 0.86 HTT (0.31) HTT

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