SCHEMBL26518759

SCHEMBL26518759

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ENPP3 O14638 1/20 0.32
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 2/20 0.31
HTT P42858 1/20 0.31
PAX8 Q06710 1/20 0.31
NR1H4 Q96RI1 1/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
PDK2 Q15119 1/20 0.31
CYP1A1 P04798 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP1B1 Q16678 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
SCHEMBL26514699 0.92 ENPP1 (0.32) ENPP1SMN1; SMN2MAPTNR1H4TP53
SCHEMBL26512994 0.92 MAPT (0.36) SMN1; SMN2HPGDL3MBTL1MAPTLMNA
SCHEMBL26518910 0.91 ENPP1 (0.31) ENPP1
SCHEMBL26513020 0.90 MAPT (0.34) ENPP1SMN1; SMN2MAPTLMNARAB9A
SCHEMBL26516141 0.90 ENPP1 (0.34) ENPP1SMN1; SMN2HPGDL3MBTL1ENPP3
SCHEMBL26513016 0.89 MAPT (0.33) SMN1; SMN2MAPTLMNARAB9ANR1H4
SCHEMBL26513005 0.89 BRD4 (0.41) HPGDMAPTLMNAHTTCYP1A1
SCHEMBL26513001 0.89 BRD4 (0.41) HPGDMAPTLMNAHTTCYP1A1
SCHEMBL26513053 0.89 GPR84 (0.36) SMN1; SMN2MAPTLMNARAB9ANR1H4
SCHEMBL25604650 0.87 GPR84 (0.34) HPGDMAPTLMNARAB9AHTT

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 1 patent. 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