SCHEMBL9905206

SCHEMBL9905206

Cn1c(=O)n(CCN2CCOCC2)c2c3cc(-c4cnc(N)c(C(F)(F)F)c4)ccc3ncc21

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 12/20 0.53
▸ MTOR P42345 11/20 0.51
▸ ATM Q13315 15/20 0.50
▸ ATR Q13535 5/20 0.50

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
SCHEMBL367961 0.86 PIK3CA (0.48) PIK3CAMTORATMATR
SCHEMBL367962 0.86 PIK3CA (0.48) PIK3CAMTORATMATR
SCHEMBL9905072 0.83 PIK3CD (0.60) PIK3CAMTORATMATR
SCHEMBL9905352 0.79 ATM (0.67) PIK3CAMTORATMATR
SCHEMBL9905279 0.78 PIK3CA (0.51) PIK3CAMTORATMATR
SCHEMBL16055759 0.78 MTOR (0.53) PIK3CAMTORATMATR
SCHEMBL3513926 0.77 PIK3CA (0.47) PIK3CAMTORATMATR
SCHEMBL16054954 0.77 MTOR (0.49) PIK3CAMTORATMATR
SCHEMBL9905281 0.77 PIK3CA (0.52) PIK3CAMTORATMATR
SCHEMBL3513940 0.77 PIK3CA (0.46) PIK3CAMTORATMATR

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 6 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
EP-2648733-A1 SUBSTITUTED IMIDAZOQUINOLINE DERIVATIVES Piramal Enterprises Limited (IN) 2013-10-16 — — EP claimed
WO-2012077031-A1 SUBSTITUTED IMIDAZOQUINOLINE DERIVATIVES PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-06-14 — — WO 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 PIK3CA 154/4885MTOR 220/4885ATM 862/4885

“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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