SCHEMBL26512892

SCHEMBL26512892

CCC1(CC)c2ccccc2-c2c1c1c(c3cc(OC)c(OC)cc23)OC(c2ccc(OC)cc2)(c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2)C=C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.37
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
KDM4E B2RXH2 6/20 0.34
MAPT P10636 6/20 0.34
ALDH1A1 P00352 4/20 0.34
HPGD P15428 3/20 0.34
HTT P42858 3/20 0.34
LMNA P02545 2/20 0.34
ACACA Q13085 2/20 0.34
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NTSR1 P30989 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
NPC1 O15118 1/20 0.32

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
SCHEMBL26512895 1.00 BRD4 (0.37) BRD4MAOAMAOBKDM4EMAPT
SCHEMBL26512886 0.96 NTSR1 (0.33) BRD4MAOAMAOBKDM4EMAPT
SCHEMBL26512898 0.94 BRD4 (0.33) BRD4MAOAMAOBKDM4EMAPT
SCHEMBL26512899 0.94 KDM4E (0.36) BRD4KDM4EMAPTALDH1A1HPGD
SCHEMBL26512783 0.94 BRD4 (0.39) BRD4MAOAMAOBKDM4EMAPT
SCHEMBL26512774 0.94 BRD4 (0.39) BRD4MAOAMAOBKDM4EMAPT
SCHEMBL26512983 0.93 MEN1 (0.32) BRD4MAOAMAOBKDM4EALDH1A1
SCHEMBL26512894 0.93 KDM4E (0.32) BRD4KDM4EMAPTALDH1A1HPGD
SCHEMBL26512933 0.92 WHR1 (0.33) KDM4EALDH1A1MEN1KMT2AHSD17B10
SCHEMBL25717226 0.92 EDNRB (0.32)

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