SCHEMBL4075854

SCHEMBL4075854

COc1ccc(CN(Cc2cc3cccc(C)c3[nH]c2=O)C(=S)NCc2ccco2)cc1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.72
MEN1 O00255 5/20 0.71
KMT2A Q03164 5/20 0.71
MAPT P10636 2/20 0.71
LMNA P02545 6/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
KDM4E B2RXH2 9/20 0.62
HSD17B10 Q99714 2/20 0.62
ALOX15 P16050 1/20 0.62
MAPK1 P28482 1/20 0.62
GUSB P08236 1/20 0.59
NPC1 O15118 1/20 0.59
TDP1 Q9NUW8 1/20 0.57
HPGD P15428 1/20 0.57
PKM P14618 1/20 0.55

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
SCHEMBL30307298 0.77 ALDH1A1 (0.82) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL4078861 0.75 SMN1; SMN2 (0.66) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL4075241 0.74 ALDH1A1 (0.57) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL13496401 0.73 ALDH1A1 (0.84) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL13496402 0.73 KMT2A (0.83) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL12594548 0.73 ALDH1A1 (0.83) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL13496413 0.72 KMT2A (0.82) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL13496417 0.71 ALDH1A1 (0.80) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL13496406 0.70 ALDH1A1 (0.80) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL14068803 0.70 ALDH1A1 (0.68) ALDH1A1MEN1KMT2ALMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2040711-A2 2-OXO-1,2-DIHYDROQUINOLINE DERIVATIVES, COMPOSITIONS, AND USES THEREOF AS ANTIPROLIFERATIVE AGENTS Amphora Discovery Corporation (US) 2009-04-01 EP claimed
US-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 US claimed
WO-2007136592-A2 2-0X0-L,2-DIHYDR0QUIN0LINE DERIVATIVES, COMPOSITIONS, AND USES THEREOF AS ANTIPROLIFERATIVE AGENTS AMPHORA DISCOVERY CORPORATION (US) 2007-11-29 WO claimed
EP-2040711-A2 2-OXO-1,2-DIHYDROQUINOLINE DERIVATIVES, COMPOSITIONS, AND USES THEREOF AS ANTIPROLIFERATIVE AGENTS Amphora Discovery Corporation (US) 2009-04-01 EP disclosed
US-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 US disclosed
WO-2007136592-A2 2-0X0-L,2-DIHYDR0QUIN0LINE DERIVATIVES, COMPOSITIONS, AND USES THEREOF AS ANTIPROLIFERATIVE AGENTS AMPHORA DISCOVERY CORPORATION (US) 2007-11-29 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-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof ABCG2, ATP5ME, ATP5MG ALDH1A1 1055/4885MEN1 3178/4885KMT2A 2810/4885

“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.