SCHEMBL14925554

SCHEMBL14925554

CC(C)c1cc(C(=O)N2CCOCC2)[nH]n1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALPL P05186 2/20 0.51
▸ HSP90AA1 P07900 2/20 0.47
▸ HSP90AB1 P08238 2/20 0.47
▸ POLB P06746 2/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ MME P08473 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ TACR3 P29371 1/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ HPGD P15428 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ HRH3 Q9Y5N1 2/20 0.39
▸ FKBP1A P62942 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
SCHEMBL13779967 0.84 ALPL (0.52) ALPLHRH3
SCHEMBL16812287 0.82 NPC1 (0.44) KMT2AALDH1A1SMN1; SMN2HPGD
SCHEMBL8001697 0.81 ALPL (0.54) ALPLPOLBKMT2AALDH1A1SMN1; SMN2
SCHEMBL18161035 0.81 KDM5A (0.44) ALPL
SCHEMBL14213423 0.80 ALPL (0.48) ALPLHSP90AA1HSP90AB1POLBKMT2A
SCHEMBL15258523 0.78 TSHR (0.51) HSP90AA1POLBKMT2ASMN1; SMN2HTT
SCHEMBL15258531 0.78 KDM4E (0.51) KMT2AALDH1A1SMN1; SMN2TACR3HPGD
SCHEMBL14235824 0.77 ALPL (0.51) ALPLPOLBKMT2AALDH1A1SMN1; SMN2
SCHEMBL17682652 0.77 KDM5A (0.69) —
SCHEMBL17672418 0.76 KDM5A (0.45) —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE48239-E1 Heteroaryl pyridone and aza-pyridone compounds GENETECH, INC. (US) 2020-10-06 — — US disclosed
US-8716274-B2 Heteroaryl pyridone and aza-pyridone compounds GENENTECH, INC. (US) 2014-05-06 — — US disclosed
US-20130116235-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2013-05-09 — — 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-20130116235-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS BTK, PDXK, TYK2 ALPL 2734/4885HSP90AA1 3955/4885HSP90AB1 3624/4885

“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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