SCHEMBL9905282

SCHEMBL9905282

Cn1c(=O)n(-c2ccc(N3CCOCC3)nc2)c2c3cc(-c4cnc5ccccc5c4)ccc3ncc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 13/20 0.62
▸ PIK3CA P42336 10/20 0.62
▸ PIK3C2A O00443 2/20 0.62
▸ PIK3C2B O00750 2/20 0.62
▸ PIK3CD O00329 9/20 0.61
▸ ATM Q13315 8/20 0.61
▸ PIK3CB P42338 6/20 0.61
▸ PIK3CG P48736 6/20 0.61
▸ ATR Q13535 6/20 0.61
▸ PRKDC P78527 2/20 0.61
▸ CHEK1 O14757 1/20 0.61
▸ ABCB11 O95342 1/20 0.61
▸ CSF1R P07333 1/20 0.61
▸ MET P08581 1/20 0.61
▸ PIK3R1 P27986 1/20 0.61
▸ LTK P29376 1/20 0.61
▸ CDK7 P50613 1/20 0.61
▸ NEK2 P51955 1/20 0.61
▸ JAK3 P52333 1/20 0.61
▸ LIMK1 P53667 1/20 0.61

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
SCHEMBL993850 0.84 MTOR (0.73) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL9905298 0.83 MTOR (0.68) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL15747835 0.82 MTOR (0.69) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL927006 0.82 MTOR (0.71) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL9905317 0.81 MTOR (0.66) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL9905096 0.81 MTOR (0.66) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL928310 0.81 MTOR (0.67) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL9905120 0.81 MTOR (0.70) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL9905477 0.81 MTOR (0.72) MTORPIK3CAPIK3C2APIK3C2BPIK3CD
SCHEMBL9905287 0.81 MTOR (0.67) MTORPIK3CAPIK3C2APIK3C2BPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130310374-A1 Substituted Imidazoquinoline Derivatives PIRAMAL ENTERPRISES LIMITED` (IN) 2013-11-21 — — US claimed
US-20130310374-A1 Substituted Imidazoquinoline Derivatives PIRAMAL ENTERPRISES LIMITED` (IN) 2013-11-21 — — US disclosed
EP-2648733-A1 SUBSTITUTED IMIDAZOQUINOLINE DERIVATIVES Piramal Enterprises Limited (IN) 2013-10-16 — — EP disclosed
WO-2012077031-A1 SUBSTITUTED IMIDAZOQUINOLINE DERIVATIVES PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-06-14 — — WO 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-20130310374-A1 Substituted Imidazoquinoline Derivatives FLT4, CDK4, CDK2 MTOR 220/4885PIK3CA 154/4885PIK3C2A 310/4885

“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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