SCHEMBL20402219

SCHEMBL20402219

CCCCCCCCn1c2cc(C#Cc3ccc(-c4ccc(-c5cccs5)s4)s3)ccc2c2ccc3c(ccc4c5ccc(C#Cc6ccc(-c7ccc(-c8cccs8)s7)s6)cc5sc43)c21

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ PSEN1 P49768 5/20 0.31
▸ PSEN2 P49810 5/20 0.31
▸ APH1B Q8WW43 5/20 0.31
▸ NCSTN Q92542 5/20 0.31
▸ APH1A Q96BI3 5/20 0.31
▸ PSENEN Q9NZ42 5/20 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
SCHEMBL20402189 0.83 ALDH1A1 (0.37) KDM4EALDH1A1GAAPSEN1PSEN2
SCHEMBL20402178 0.82 PSEN1 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20402210 0.82 PSEN1 (0.31) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20402206 0.80 PSEN1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL15024908 0.80 ALDH1A1 (0.35) KDM4EALDH1A1GAA
SCHEMBL20402214 0.80 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20402217 0.80 KDM4E (0.35) KDM4EALDH1A1GAAPSEN1PSEN2
SCHEMBL20402204 0.80 PSEN1 (0.38) KDM4EPSEN1PSEN2APH1BNCSTN
SCHEMBL20402205 0.80 PSEN1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20402215 0.78 CYP1A1 (0.41) PSEN1PSEN2APH1BNCSTNAPH1A

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
US-10032993-B2 Aromatic heterocyclic compound, manufacturing method thereof, organic semiconductor material, and organic semiconductor device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2018-07-24 — — 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 (1 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-10032993-B2 Aromatic heterocyclic compound, manufacturing method thereof, organic semiconductor material, and organic semiconductor device PAH, TYR, SLCO2A1 KDM4E 1098/4885ALDH1A1 2073/4885GAA 3268/4885

“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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