SCHEMBL1541111

SCHEMBL1541111

Cc1ccnc(C(=O)O)c1I

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.46
ASPH Q12797 5/20 0.46
KDM8 Q8N371 5/20 0.46
ALDH1A1 P00352 6/20 0.44
MAPT P10636 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
BLM P54132 1/20 0.44
AGER Q15109 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MYC P01106 1/20 0.43
KMT2A Q03164 1/20 0.39
CYP1A2 P05177 1/20 0.39
LMNA P02545 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
P4HTM Q9NXG6 1/20 0.38
ATM Q13315 1/20 0.36
CCR1 P32246 1/20 0.35

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
SCHEMBL7199668 0.81 KDM4E (0.47) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL14284234 0.79 KDM4E (0.46) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL30049082 0.79 KDM4E (0.50) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL9684174 0.79 KDM4E (0.50) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL23500420 0.78 MYC (0.46) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL28380748 0.78 KDM4E (0.63) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL28582520 0.78 KDM4E (0.48) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL13603259 0.78 KDM4E (0.44) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL16598801 0.78 NOS3 (0.52) KDM4EASPHKDM8ALDH1A1MAPT
SCHEMBL31116875 0.76 MYC (0.45) KDM4EASPHKDM8ALDH1A1MAPT

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-20110112299-A1 TETRACYCLIC COMPOUND KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-05-12 US disclosed
EP-2308880-A1 TETRACYCLIC COMPOUND Kyowa Hakko Kirin Co., Ltd. (JP) 2011-04-13 EP 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-20110112299-A1 TETRACYCLIC COMPOUND REN, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, LPXN KDM4E 3166/4885ASPH 2745/4885KDM8 2905/4885

“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.