SCHEMBL6139727

SCHEMBL6139727

COc1cc2c(-c3cc4cccnc4[nH]3)cn(CC(=O)N3CCOCC3)c2cc1OC.Cn1cc(-c2cc3cccnc3[nH]2)c2cc(OCC(=O)O)ccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.55
SYK P43405 1/20 0.44
LCK P06239 2/20 0.41
GSK3A P49840 2/20 0.41
GSK3B P49841 2/20 0.41
CDK7 P50613 2/20 0.41
LRRK2 Q5S007 2/20 0.41
AURKB Q96GD4 2/20 0.41
JAK2 O60674 1/20 0.41
BTK Q06187 1/20 0.41
RAB9A P51151 2/20 0.40
RIPK1 Q13546 1/20 0.40
G6PD P11413 1/20 0.39
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2B Q13224 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
SCHEMBL1778705 0.89 IGF1R (0.58) IGF1RSYKRAB9ARIPK1G6PD
SCHEMBL12606279 0.86 SYK (0.55) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1778184 0.85 RAB9A (0.49) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1748575 0.84 IGF1R (0.68) IGF1RSYKRIPK1MAPTSMN1; SMN2
SCHEMBL1777457 0.83 G6PD (0.48) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1748730 0.83 IGF1R (0.59) IGF1RSYKRIPK1MAPTSMN1; SMN2
SCHEMBL1779688 0.82 SYK (0.61) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1778941 0.82 DRD2 (0.48) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1749496 0.80 IGF1R (0.62) IGF1RSYKRIPK1CDK9
SCHEMBL1749103 0.80 IGF1R (0.80) IGF1RSYKLCKGSK3AGSK3B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders AVENTIS PHARMACEUTICALS INC. (US) 2005-12-01 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-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders MAP3K20, MAP3K12, MAP3K19 IGF1R 1245/4885SYK 113/4885LCK 66/4885

“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.