SCHEMBL25857386

SCHEMBL25857386

c1ccc(C2(c3ccccc3)c3ccccc3Oc3cc(-c4ccc(C5(c6ccccc6)c6ccccc6-c6c5ccc5ccccc65)cc4)ccc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DHFR P00374 2/20 0.32
TYMS P04818 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GPR84 Q9NQS5 2/20 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
SCHEMBL25857454 0.98 KDM4E (0.33) DHFRTYMSKDM4EMEN1LMNA
SCHEMBL25857387 0.94 DHFR (0.32) DHFRTYMSKDM4EMEN1LMNA
SCHEMBL25856408 0.94 GPR84 (0.32) DHFRTYMSKDM4EMEN1LMNA
SCHEMBL25857381 0.94 DHFR (0.30) DHFRTYMS
SCHEMBL25847991 0.93 KDM4E (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25867582 0.93 CHRNA1 (0.31) KDM4E
SCHEMBL25857452 0.93
SCHEMBL25847579 0.92 PDK2 (0.30) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25867638 0.92 PDK2 (0.30) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25857455 0.92 KDM4E (0.33) DHFRTYMSKDM4EMEN1LMNA

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-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed