SCHEMBL4316548

SCHEMBL4316548

COc1c(OCC(=O)N2CCC(O)C2)ccc(C=Cc2n[nH]c3ccccc23)c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
HSD17B10 Q99714 3/20 0.43
HPGD P15428 3/20 0.43
TP53 P04637 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 3/20 0.42
GAA P10253 2/20 0.42
TSHR P16473 1/20 0.42
AURKA O14965 2/20 0.37
AURKB Q96GD4 2/20 0.37
BMPR1B O00238 1/20 0.37
PLK4 O00444 1/20 0.37
STK25 O00506 1/20 0.37
CIT O14578 1/20 0.37
RIOK3 O14730 1/20 0.37
CHEK1 O14757 1/20 0.37

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
SCHEMBL4316532 1.00 KDM4E (0.43) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4316556 1.00 KDM4E (0.43) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4327247 0.88 NPC1 (0.39) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4327254 0.88 NPC1 (0.39) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4327259 0.88 NPC1 (0.39) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4320787 0.87 TP53 (0.45) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4320803 0.87 TP53 (0.45) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4320503 0.86 ALDH1A1 (0.45) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4320490 0.86 ALDH1A1 (0.45) KDM4ERAB9ANPC1HSD17B10HPGD
SCHEMBL4314405 0.77 CHEK1 (0.37) KDM4ERAB9ANPC1KMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605272-B2 IGF-1R inhibitor KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-10-20 US disclosed
US-20090054508-A1 IGF-1R INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-02-26 US disclosed
EP-1847532-A1 IGF-1R INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-10-24 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-20090054508-A1 IGF-1R INHIBITOR IGF1R, IGFBP5, IGFBP1 KDM4E 1251/4885RAB9A 2711/4885NPC1 2575/4885

“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.