SCHEMBL23114366

SCHEMBL23114366

COC1c2ccc(cc2)C1OC

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.33
ELANE P08246 1/20 0.32
KDM1A O60341 2/20 0.32
NR3C1 P04150 2/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32

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
SCHEMBL10144963 0.62
SCHEMBL19489752 0.61 POLB (0.54)
SCHEMBL14071573 0.55 ELANE (0.33) ELANE
P-Xylene SCHEMBL4858832 0.48 ACHE (0.73) CA1CA2CA7CA9
1,4-Dimethoxybenzene SCHEMBL21802643 0.48 CA1 (1.00) CA12CA1CA2CA7CA9
1,4-Dimethoxybenzene SCHEMBL8489 0.48 CA1 (1.00) CA12CA1CA2CA7CA9
SCHEMBL15427202 0.47
SCHEMBL3050796 0.46
Naphthalene SCHEMBL8679262 0.46 CYP2A6 (0.67) CA12CA1CA2CA7CA9
SCHEMBL1320551 0.44

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11034797-B2 Polyimide precursor composition, use thereof and polyimide made therefrom ETERNAL MATERIALS CO., LTD. (TW) 2021-06-15 US disclosed
US-20210079161-A1 POLYIMIDE PRECURSOR COMPOSITION, USE THEREOF AND POLYIMIDE MADE THEREFROM ETERNAL MATERIALS CO., LTD. (TW) 2021-03-18 US disclosed