SCHEMBL4077969

SCHEMBL4077969

Cc1cc(C)c2[nH]c(=O)c(CN(Cc3ccc4c(c3)OCO4)C(=O)C3CCCC3)cc2c1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.61
ALDH1A1 P00352 12/20 0.61
HSD17B10 Q99714 10/20 0.61
TSHR P16473 8/20 0.61
NPSR1 Q6W5P4 5/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
HTT P42858 3/20 0.61
ALOX15 P16050 3/20 0.61
CASP1 P29466 1/20 0.61
USP2 O75604 4/20 0.53
PKM P14618 2/20 0.53
HPGD P15428 3/20 0.51
POLB P06746 2/20 0.51
MAPT P10636 2/20 0.51
ALOX12 P18054 1/20 0.51
LMNA P02545 2/20 0.49
MAPK1 P28482 1/20 0.49
GUSB P08236 1/20 0.49

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
SCHEMBL4069208 0.99 KDM4E (0.60) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL5463453 0.96 KDM4E (0.59) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL4075220 0.92 KDM4E (0.56) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL4079883 0.90 KDM4E (0.55) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL4073672 0.85 ALDH1A1 (0.58) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL5448947 0.85 KDM4E (0.66) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL4079782 0.85 KDM4E (0.56) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL4070699 0.85 ALDH1A1 (0.55) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL4070133 0.84 KDM4E (0.55) KDM4EALDH1A1HSD17B10TSHRNPSR1
SCHEMBL5443445 0.84 KDM4E (0.56) KDM4EALDH1A1HSD17B10TSHRNPSR1

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 4 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
US-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 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-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof ABCG2, ATP5ME, ATP5MG KDM4E 2403/4885ALDH1A1 1055/4885HSD17B10 1580/4885

“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.