SCHEMBL27361602

SCHEMBL27361602

CC1(C)OB(c2cc(-c3nc4c(ccc5ccccc54)o3)c3ccccc3c2)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
LPL P06858 2/20 0.40
LIPG Q9Y5X9 2/20 0.40
PTPN1 P18031 7/20 0.39
ALDH1A1 P00352 4/20 0.38
HPGD P15428 4/20 0.38
MAPT P10636 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 2/20 0.38
SIRT2 Q8IXJ6 5/20 0.37
SIRT1 Q96EB6 5/20 0.37
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
KDM4E B2RXH2 3/20 0.35
GAA P10253 2/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
USP2 O75604 1/20 0.34

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
SCHEMBL27361503 0.82 LPL (0.52) TDP1LPLLIPGPTPN1ALDH1A1
SCHEMBL27361603 0.80 LIPG (0.44) TDP1LPLLIPGPTPN1ALDH1A1
SCHEMBL27363578 0.79 LIPG (0.49) TDP1LPLLIPGPTPN1ALDH1A1
SCHEMBL26450536 0.77 ALDH1A1 (0.41) LPLLIPGALDH1A1HPGDMAPT
SCHEMBL26450480 0.76 ALDH1A1 (0.41) LPLLIPGALDH1A1HPGDMAPT
SCHEMBL29340625 0.75 SIRT2 (0.35) TDP1PTPN1ALDH1A1HPGDMAPT
SCHEMBL20987928 0.74 LIPG (0.54) LPLLIPGALDH1A1HPGDMAPT
SCHEMBL27403658 0.73 ESR1 (0.58) TDP1LPLLIPGALDH1A1HPGD
SCHEMBL2261034 0.72 LPL (0.58) TDP1LPLLIPGALDH1A1HPGD
SCHEMBL18015668 0.72 LPL (0.48) TDP1LPLLIPGMAPT

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
WO-2024039056-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2024-02-22 WO disclosed