SCHEMBL4312353

SCHEMBL4312353

COc1cc(/C=C/c2n[nH]c3ccccc23)c(N)cc1OCCN1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 1/20 0.44
PDPK1 O15530 1/20 0.43
CHEK1 O14757 4/20 0.42
MAOB P27338 1/20 0.42
MAPK13 O15264 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
MAPK14 Q16539 1/20 0.41
EGFR P00533 2/20 0.41
GRM4 Q14833 1/20 0.41
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
SRC P12931 2/20 0.40
ALDH1A1 P00352 2/20 0.40
PDGFRB P09619 1/20 0.40
FGFR1 P11362 1/20 0.40
KDR P35968 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
SYK P43405 1/20 0.39

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
SCHEMBL4312360 1.00 KIT (0.44) KITPDPK1CHEK1MAOBMAPK13
SCHEMBL4313587 0.96 CHEK1 (0.47) CHEK1EGFRKEAP1NFE2L2SRC
SCHEMBL4313598 0.96 CHEK1 (0.47) CHEK1EGFRKEAP1NFE2L2SRC
SCHEMBL4315583 0.86 CHEK1 (0.46) CHEK1MAOBMAPK13MAPK12MAPK11
SCHEMBL4315576 0.86 CHEK1 (0.46) CHEK1MAOBMAPK13MAPK12MAPK11
Hydrochloric Acid SCHEMBL5692287 0.84 LRRK2 (0.48) CHEK1MAOBMAPK13MAPK12MAPK11
Hydrochloric Acid SCHEMBL5692292 0.84 LRRK2 (0.48) CHEK1MAOBMAPK13MAPK12MAPK11
SCHEMBL4312096 0.84 FGFR1 (0.49) MAOBMAPK14GRM4SRCALDH1A1
SCHEMBL4312094 0.84 FGFR1 (0.49) MAOBMAPK14GRM4SRCALDH1A1
SCHEMBL5693211 0.82 MAOB (0.45) KITPDPK1CHEK1MAOBMAPK13

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 KIT 720/4885PDPK1 1391/4885CHEK1 3274/4885

“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.