SCHEMBL15877219

SCHEMBL15877219

[O-][n+]1ccc(OCc2cn3cnccc3n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ RAB9A P51151 4/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ PDE10A Q9Y233 1/20 0.42
▸ GRM5 P41594 11/20 0.38
▸ HPGD P15428 1/20 0.37
▸ MAPT P10636 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33

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
SCHEMBL3476282 0.80 KDM4E (0.67) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A
SCHEMBL15876919 0.73 NSD2 (0.45) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A
SCHEMBL11427962 0.70 KDM4E (0.72) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A
SCHEMBL27108411 0.69 MAOA (0.39) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A
SCHEMBL12335783 0.69 KDM4E (0.36) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A
SCHEMBL9570209 0.66 PDE10A (0.34) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A
SCHEMBL2961962 0.66 KDM4E (0.55) SMN1; SMN2ALDH1A1KDM4EPDE10AHPGD
SCHEMBL9597058 0.66 PDE10A (0.34) SMN1; SMN2ALDH1A1KDM4ERAB9ANPC1
SCHEMBL2942757 0.65 KDM4E (0.54) ALDH1A1KDM4EPDE10AHPGDPOLB
SCHEMBL29958329 0.65 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1LMNAKDM4ERAB9A

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-20140206696-A1 (1-AZINONE)-SUBSTITUTED PYRIDOINDOLES ALBANY MOLECULAR RESEARCH, INC. (US) 2014-07-24 — — 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-20140206696-A1 (1-AZINONE)-SUBSTITUTED PYRIDOINDOLES NR3C2, NR2E3, NR0B1 SMN1; SMN2 2052/4885ALDH1A1 2106/4885LMNA 1957/4885

“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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