SCHEMBL16502134

SCHEMBL16502134

Cc1ccc(N2c3ccc(-c4cccc5ccccc45)cc3Oc3cc(-c4cccc5ccccc45)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.40
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ ENPP3 O14638 1/20 0.39
▸ ENPP1 P22413 1/20 0.39
▸ FLT3 P36888 1/20 0.39
▸ CHRNA1 P02708 1/20 0.37
▸ CHRNG P07510 1/20 0.37
▸ CHRNB1 P11230 1/20 0.37
▸ CHRNB2 P17787 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ CHRNB4 P30926 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ CHRNA3 P32297 1/20 0.37
▸ CHRNA4 P43681 1/20 0.37
▸ SLC6A3 Q01959 1/20 0.37
▸ CHRND Q07001 1/20 0.37
▸ MCL1 Q07820 1/20 0.36
▸ ACMSD Q8TDX5 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL16502126 0.94 ALDH1A1 (0.38) ALDH1A1MAOAMAOBENPP3ENPP1
SCHEMBL18083602 0.84 MAOA (0.41) ALDH1A1MAOAMAOBENPP3ENPP1
SCHEMBL13326577 0.83 ALOX5 (0.40) ALDH1A1MAOBKDM4EGPR84EGFR
SCHEMBL17206598 0.82 PDE6D (0.43) ALDH1A1ENPP3ENPP1MCL1ACMSD
SCHEMBL16502170 0.82 MEN1 (0.40) ALDH1A1MAOAMAOBENPP3ENPP1
SCHEMBL16502133 0.81 ALDH1A1 (0.46) ALDH1A1POLBKDM4ETDP1EGFR
SCHEMBL17206602 0.81 CA12 (0.40) ENPP3ENPP1MCL1ACMSDPOLB
SCHEMBL16889834 0.81 MAOA (0.33) ALDH1A1MAOAMAOBENPP3ENPP1
SCHEMBL15470486 0.80 PLA2G2A (0.37) ALDH1A1MCL1ACMSDKDM4EEDNRB
SCHEMBL22183336 0.80 MAOA (0.32) MAOAMAOBENPP3CHRNA1CHRNG

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-20110309341-A1 AMINE POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMATION CO., LTD. (JP) 2011-12-22 — — US disclosed
US-20110309341-A1 AMINE POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMATION CO., LTD. (JP) 2011-12-22 — — 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 (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-20110309341-A1 AMINE POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME AHR, HRH3, HRH4 ALDH1A1 431/4885MAOA 99/4885MAOB 135/4885

“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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