SCHEMBL16868889

SCHEMBL16868889

O=C1c2ccccc2CN1CCN1CCNCCNCCNCC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 4/20 0.55
▸ DRD5 P21918 4/20 0.55
▸ DRD3 P35462 4/20 0.55
▸ HTR1A P08908 1/20 0.55
▸ HTR7 P34969 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ SIRT1 Q96EB6 1/20 0.54
▸ ACHE P22303 1/20 0.49
▸ NPC1 O15118 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL30073106 0.83 KDM4E (0.72) DRD2DRD5DRD3HTR1AHTR7
SCHEMBL30073110 0.83 KDM4E (0.72) DRD2DRD5DRD3HTR1AHTR7
SCHEMBL29676790 0.78 HTR7 (0.62) DRD2DRD5DRD3HTR1AHTR7
SCHEMBL5659084 0.78 ACHE (0.62) DRD2DRD5DRD3HTR1AHTR7
Hydrochloric Acid SCHEMBL5658146 0.77 ACHE (0.61) DRD2DRD5DRD3HTR1AHTR7
SCHEMBL29802804 0.75 DRD3 (0.67) DRD2DRD5DRD3HTR1AHTR7
SCHEMBL29564155 0.75 HTR1A (0.55) HTR1A
SCHEMBL20404 0.75 HTR1A (0.55) HTR1A
SCHEMBL6716162 0.75 DRD3 (0.69) DRD2DRD5DRD3HTR1AHTR7
SCHEMBL8242914 0.73 KDM4E (0.64) DRD2DRD5DRD3HTR1AHTR7

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-9429568-B2 Silaanthracene as a red and near infrared sensor and a method to manufacture such a sensor BOARD OF TRUSTEES OF SOUTHERN ILLINOIS UNIVERSITY ON BEHALF OF SOUTHERN ILLINOIS UNIVERSITY CARBONDALE (US) 2016-08-30 — — US disclosed
US-20150185209-A1 BIOLOGICALLY ACTIVE COMPLEX AND ITS PREPARATION SOUTHERN ILLINOIS UNIVERSITY CARBONDALE (US) 2015-07-02 — — 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-20150185209-A1 BIOLOGICALLY ACTIVE COMPLEX AND ITS PREPARATION PGLS, FOS, SPR DRD2 4803/4885DRD5 4651/4885DRD3 4673/4885

“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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