SCHEMBL4391397

SCHEMBL4391397

C1CC2CC12.CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(C(CC2CCN(C(=O)OC(C)(C)C)CC2)NC(N)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
CCR8 P51685 1/20 0.41
TGFBR1 P36897 3/20 0.40
GPR119 Q8TDV5 3/20 0.39
HDAC1 Q13547 4/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LIMK2 P53671 1/20 0.37
ITGB3 P05106 2/20 0.36
ITGA2B P08514 2/20 0.36
YAP1 P46937 1/20 0.36

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
SCHEMBL2474233 0.85 KDM4E (0.46) KDM4EPKMCCR8TGFBR1HDAC1
SCHEMBL3835595 0.84 KDM4E (0.45) KDM4EPKMCCR8TGFBR1HDAC1
SCHEMBL3832630 0.81 NPC1 (0.51) KDM4EPKMCCR8TGFBR1GPR119
SCHEMBL20601233 0.77 KDM4E (0.66) KDM4EPKMCCR8TGFBR1GPR119
SCHEMBL20618718 0.77 KDM4E (0.58) KDM4EPKMCCR8TGFBR1GPR119
SCHEMBL20601477 0.77 KDM4E (0.58) KDM4EPKMTGFBR1GPR119KMT2A
SCHEMBL3830420 0.76 KDM4E (0.59) KDM4EPKMCCR8TGFBR1GPR119
SCHEMBL20601549 0.76 KDM4E (0.59) KDM4EPKMTGFBR1GPR119KMT2A
SCHEMBL20601482 0.76 KDM4E (0.59) KDM4EPKMGPR119KMT2ALIMK2
SCHEMBL2830416 0.75 NAMPT (0.59) KDM4EPKMCCR8GPR119HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8076332-B2 N- (2-aminophenyl) benzamide derivative having urea structure SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-12-13 US disclosed
US-20090306077-A1 NOVEL N- (2-AMINOPHENYL) BENZAMIDE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-12-10 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-20090306077-A1 NOVEL N- (2-AMINOPHENYL) BENZAMIDE DERIVATIVE HAVING UREA STRUCTURE UACA, SLC14A1, ARG2 KDM4E 1820/4885PKM 2000/4885CCR8 3992/4885

“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.