SCHEMBL4317409

SCHEMBL4317409

COC(=O)c1ccc(/C=C/c2n[nH]c3ccccc23)c(NC(=O)c2sccc2C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 2/20 0.56
▸ AURKB Q96GD4 2/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ HPGD P15428 3/20 0.45
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ FLT3 P36888 1/20 0.43
▸ FGFR1 P11362 3/20 0.41
▸ KDR P35968 3/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CYP2C19 P33261 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ CYP3A4 P08684 2/20 0.38

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
SCHEMBL4317413 1.00 AURKA (0.56) AURKAAURKBSMN1; SMN2HPGDNPC1
SCHEMBL4314044 0.91 AURKA (0.57) AURKAAURKBSMN1; SMN2NPC1RAB9A
SCHEMBL4314052 0.91 AURKA (0.57) AURKAAURKBSMN1; SMN2NPC1RAB9A
SCHEMBL4325870 0.90 AURKA (0.56) AURKAAURKBSMN1; SMN2HPGDNPC1
SCHEMBL4325877 0.90 AURKA (0.56) AURKAAURKBSMN1; SMN2HPGDNPC1
Hydrochloric Acid SCHEMBL4315453 0.89 AURKA (0.55) AURKAAURKBSMN1; SMN2HPGDNPC1
Hydrochloric Acid SCHEMBL4315459 0.89 AURKA (0.55) AURKAAURKBSMN1; SMN2HPGDNPC1
SCHEMBL4327023 0.88 AURKA (0.58) AURKAAURKBSMN1; SMN2HPGDNPC1
SCHEMBL4327020 0.88 AURKA (0.58) AURKAAURKBSMN1; SMN2HPGDNPC1
SCHEMBL4308236 0.87 AURKA (0.56) AURKAAURKBSMN1; SMN2HPGDNPC1

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 AURKA 3687/4885AURKB 3438/4885SMN1; SMN2 3100/4885

“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.

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