SCHEMBL24317038

SCHEMBL24317038

Bc1c2ccccc2c(-c2cccc3c2C2(c4c-3ccc3ccccc43)C3CC4CC(C3)CC2C4)c2ccccc12

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DNMT1 P26358 1/20 0.31

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
SCHEMBL25618473 0.85 HSD11B1 (0.35) MEN1ALDH1A1MAPTRAB9AKMT2A
SCHEMBL25625946 0.85 CA12 (0.35) MEN1ALDH1A1MAPTRAB9AKMT2A
SCHEMBL25614945 0.84
SCHEMBL24316449 0.83
SCHEMBL25614651 0.82 TDP1 (0.34)
SCHEMBL25657017 0.82 CYP1A2 (0.39) MEN1ALDH1A1MAPTRAB9AKMT2A
SCHEMBL24316494 0.81
SCHEMBL24316376 0.81
SCHEMBL24316483 0.80 CYP2A6 (0.40) MEN1ALDH1A1MAPTRAB9AKMT2A
SCHEMBL25657018 0.80 DHFR (0.34) MEN1ALDH1A1MAPTRAB9AKMT2A

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-2022068292-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME 陕西莱特光电材料股份有限公司 2022-04-07 WO disclosed