SCHEMBL18326977

SCHEMBL18326977

c1cc(-c2ccc(-c3cccc4ccccc34)cc2)cc(-c2cccc(N(c3cccc(-c4cccc5ccccc45)c3)c3ccc4c(c3)oc3ccccc34)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ PLA2G2A P14555 3/20 0.38
▸ PLA2G4A P47712 3/20 0.38
▸ MCL1 Q07820 1/20 0.37
▸ ACMSD Q8TDX5 1/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ HCRTR1 O43613 1/20 0.36
▸ DUSP3 P51452 1/20 0.36
▸ AHR P35869 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ENPP3 O14638 1/20 0.34
▸ ENPP1 P22413 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
SCHEMBL18326981 1.00 CA12 (0.41) CA12CA1CA2CA9PLA2G2A
SCHEMBL18326987 0.99 CA12 (0.42) CA12CA1CA2CA9PLA2G2A
SCHEMBL18326986 0.98 CA12 (0.41) CA12CA1CA2CA9PLA2G2A
SCHEMBL18326982 0.98 CA12 (0.41) CA12CA1CA2CA9PLA2G2A
SCHEMBL18326974 0.98 CA12 (0.43) CA12CA1CA2CA9PLA2G2A
SCHEMBL23237332 0.96 CA12 (0.38) CA12CA1CA2CA9PLA2G2A
SCHEMBL23224523 0.96 MCL1 (0.39) CA12CA1CA2CA9PLA2G2A
SCHEMBL18326985 0.96 CA12 (0.41) CA12CA1CA2CA9PLA2G2A
SCHEMBL23239560 0.96 MCL1 (0.39) CA12CA1CA2CA9PLA2G2A
SCHEMBL18326976 0.96 CA12 (0.41) CA12CA1CA2CA9PLA2G2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200290986-A1 MONO AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2020-09-17 — — US disclosed
US-10693079-B2 Mono amine derivatives and organic electroluminescent device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-23 — — US disclosed
US-20160372677-A1 MONO AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-22 — — US disclosed
US-20160372677-A1 MONO AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-22 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200290986-A1 MONO AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME MAOA, MAOB, TAAR1 CA12 4167/4885CA1 4106/4885CA2 3624/4885
US-10693079-B2 Mono amine derivatives and organic electroluminescent device including the same CHRM1, NAP1L1, NAT1 CA12 4202/4885CA1 3804/4885CA2 3701/4885
US-20160372677-A1 MONO AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME CHRM1, NAP1L1, NAT1 CA12 4202/4885CA1 3804/4885CA2 3701/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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