SCHEMBL14809989

SCHEMBL14809989

N#Cc1ccn(Cc2ccccc2)c1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ TSHR P16473 2/20 0.48
▸ GAA P10253 2/20 0.48
▸ PKM P14618 2/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ APP P05067 4/20 0.43
▸ KDM4E B2RXH2 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ SNCA P37840 1/20 0.40

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
SCHEMBL14809436 0.82 KDM4E (0.52) NOTUMSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL2941221 0.79 KDM4E (0.41) ALDH1A1KDM4E
SCHEMBL11439685 0.77 NOTUM (0.68) NOTUMSMN1; SMN2TSHRGAAPKM
SCHEMBL27970810 0.77 NOTUM (0.44) NOTUMSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL14809258 0.76 POLB (0.40) NOTUMSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL18779900 0.76 SMN1; SMN2 (0.55) NOTUMSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL27970803 0.76 ALDH1A1 (0.51) NOTUMSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL9356553 0.71 ALDH1A1 (0.50) SMN1; SMN2MEN1KMT2AALDH1A1TSHR
SCHEMBL23113066 0.71 CA12 (0.48) NOTUMSMN1; SMN2ALDH1A1TSHRGAA
SCHEMBL15497044 0.70 ALDH1A1 (0.51) NOTUMSMN1; SMN2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2757887-B1 PYRROLOPYRIDINONE COMPOUNDS AND METHODS FOR TREATING HIV VIIV HEALTHCARE UK LTD (GB) 2017-04-26 — — EP disclosed
EP-2757887-B1 PYRROLOPYRIDINONE COMPOUNDS AND METHODS FOR TREATING HIV VIIV HEALTHCARE UK LTD (GB) 2017-04-26 — — EP disclosed
US-9012642-B2 Pyrrolopyridinone compounds and methods for treating HIV VIIV HEALTHCARE UK LIMITED (GB) 2015-04-21 — — US disclosed
US-9012642-B2 Pyrrolopyridinone compounds and methods for treating HIV VIIV HEALTHCARE UK LIMITED (GB) 2015-04-21 — — US disclosed
US-9012642-B2 Pyrrolopyridinone compounds and methods for treating HIV VIIV HEALTHCARE UK LIMITED (GB) 2015-04-21 — — US disclosed
US-20140343092-A1 Pyrrolopyridinone Compounds And Methods For Treating HIV VIIV HEALTHCARE UK LIMITED (GB) 2014-11-20 — — US disclosed
US-20140343092-A1 Pyrrolopyridinone Compounds And Methods For Treating HIV VIIV HEALTHCARE UK LIMITED (GB) 2014-11-20 — — US disclosed
US-20140343092-A1 Pyrrolopyridinone Compounds And Methods For Treating HIV VIIV HEALTHCARE UK LIMITED (GB) 2014-11-20 — — US disclosed
EP-2757887-A1 PYRROLOPYRIDINONE COMPOUNDS AND METHODS FOR TREATING HIV VIIV Healthcare UK Limited (GB) 2014-07-30 — — EP disclosed
WO-2013043553-A1 PYRROLOPYRIDINONE COMPOUNDS AND METHODS FOR TREATING HIV GLAXOSMITHKLINE LLC (US) 2013-03-28 — — WO disclosed
WO-2013043553-A1 PYRROLOPYRIDINONE COMPOUNDS AND METHODS FOR TREATING HIV GLAXOSMITHKLINE LLC (US) 2013-03-28 — — WO 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-20140343092-A1 Pyrrolopyridinone Compounds And Methods For Treating HIV DHPS, PRNP, TYMP NOTUM 2788/4885SMN1; SMN2 1559/4885MEN1 4374/4885

“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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