SCHEMBL23790313

SCHEMBL23790313

C/C(I)=C1\Cc2ccccc2C1=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.73
▸ MAOA P21397 3/20 0.55
▸ CES1 P23141 2/20 0.52
▸ BCHE P06276 1/20 0.52
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ KDM4E B2RXH2 3/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ ACHE P22303 1/20 0.42
▸ MIF P14174 4/20 0.42
▸ MAOB P27338 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ TYR P14679 1/20 0.41
▸ RNASEH1 O60930 1/20 0.41
▸ TDP2 O95551 1/20 0.39
▸ CASP3 P42574 1/20 0.39

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
SCHEMBL7611787 0.85 ALDH1A1 (1.00) ALDH1A1MAOACES1BCHECYP1A2
SCHEMBL28270361 0.79 ALDH1A1 (0.69) ALDH1A1MAOACES1BCHECYP1A2
SCHEMBL14274025 0.78 ALDH1A1 (0.68) ALDH1A1MAOACES1BCHECYP1A2
Anthrone SCHEMBL28593418 0.76 MAOA (0.86) ALDH1A1MAOACES1BCHECYP1A2
Anthrone SCHEMBL28186814 0.75 MAOA (0.75) ALDH1A1MAOACES1BCHECYP1A2
SCHEMBL4620995 0.73 ALDH1A1 (0.61) ALDH1A1MAOACES1BCHECYP1A2
SCHEMBL2319027 0.73 MAOA (0.90) ALDH1A1MAOACES1BCHECYP1A2
Anthrone SCHEMBL29357010 0.73 MAOA (1.00) ALDH1A1MAOACES1BCHECYP1A2
Anthrone SCHEMBL29448801 0.73 MAOA (1.00) ALDH1A1MAOACES1BCHECYP1A2
Anthrone SCHEMBL18143 0.73 MAOA (1.00) ALDH1A1MAOACES1BCHECYP1A2

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-20210280791-A1 ORGANIC SEMICONDUCTING POLYMERS RAYNERGY TEK INC (TW) 2021-09-09 — — 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-20210280791-A1 ORGANIC SEMICONDUCTING POLYMERS OCIAD2, OCIAD1, OSTC ALDH1A1 1027/4885MAOA 1774/4885CES1 2968/4885

“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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