SCHEMBL27361503

SCHEMBL27361503

CC1(C)OB(c2ccc(-c3nc4c(ccc5ccccc54)o3)cc2)OC1(C)C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.52
LIPG Q9Y5X9 7/20 0.52
PTPN1 P18031 7/20 0.51
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
RCE1 Q9Y256 1/20 0.36

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
SCHEMBL27363578 0.89 LIPG (0.49) LPLLIPGPTPN1KDM4EMEN1
SCHEMBL27361603 0.85 LIPG (0.44) LPLLIPGPTPN1KDM4EMEN1
SCHEMBL27361602 0.82 TDP1 (0.41) LPLLIPGPTPN1KDM4EMEN1
SCHEMBL27361679 0.81 LPL (0.53) LPLLIPGKDM4EMEN1ALDH1A1
SCHEMBL24234858 0.79 LIPG (0.46) LPLLIPGPTPN1KDM4EALDH1A1
SCHEMBL29340452 0.79 PTPN1 (0.41) LPLLIPGPTPN1KDM4EMEN1
SCHEMBL22085393 0.79 LIPG (0.46) LPLLIPGPTPN1KDM4EALDH1A1
SCHEMBL4146587 0.79 LIPG (0.47) LPLLIPGKDM4EMEN1ALDH1A1
SCHEMBL11763574 0.78 PTPN1 (0.60) PTPN1KDM4EMEN1ALDH1A1GAA
SCHEMBL14995666 0.78 LIPG (0.56) LPLLIPG

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