SCHEMBL13626644

SCHEMBL13626644

CCNC(=O)c1cc(-c2ccccc2)c2ccccc2c1

nearest known ligand 0.75

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
MPI P34949 1/20 0.47
KMT2A Q03164 1/20 0.47
IP6K1 Q92551 1/20 0.45
BRD4 O60885 1/20 0.45
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43
NPC1 O15118 1/20 0.43
P2RY14 Q15391 1/20 0.42
PDK2 Q15119 1/20 0.42
TP53 P04637 1/20 0.42
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42

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
SCHEMBL10989422 0.81 RAB9A (0.53) ALDH1A1MAPTMEN1KMT2ANPC1
SCHEMBL162794 0.81 BRD4 (0.45) HPGDALDH1A1MAPTKDM4EIP6K1
SCHEMBL162795 0.81 BRD4 (0.45) HPGDALDH1A1MAPTKDM4EMEN1
SCHEMBL13611926 0.80 KDM4E (0.47) HPGDALDH1A1MAPTKDM4EMEN1
SCHEMBL13626646 0.78 TACR3 (0.59) HPGDALDH1A1IP6K1BRD4NPC1
SCHEMBL10988314 0.78 MEN1 (0.59) HPGDALDH1A1MAPTKDM4EMEN1
SCHEMBL14052338 0.77 HPGD (0.56) HPGDALDH1A1MAPTKDM4EMEN1
SCHEMBL13626649 0.77 PDK2 (0.50) HPGDALDH1A1MAPTKDM4EMEN1
SCHEMBL16810280 0.75 CHRNB2 (0.46) HPGDKDM4ENPC1TP53CHRNB2
SCHEMBL10993305 0.75 KDM4E (0.56) HPGDALDH1A1MAPTKDM4EMEN1

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-20090291998-A1 EPONEMYCIN AND EPOXOMICIN ANALOGS AND USES THEREOF EISAI R&D MANAGEMENT CO., LTD. 2009-11-26 US disclosed
US-7524883-B2 Eponemycin and epoxomicin analogs and uses thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 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-20090291998-A1 EPONEMYCIN AND EPOXOMICIN ANALOGS AND USES THEREOF PSMC4, PSMB6, EPOR HPGD 1585/4885ALDH1A1 2891/4885MAPT 4288/4885

“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.