SCHEMBL2954055

SCHEMBL2954055

COCCCN1CCN([C@H]2CC[C@@H](n3nc(-c4ccc5c(ccn5Cc5ccccc5Cl)c4)c4c(N)ncnc43)CC2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 10/20 0.61
▸ IGF1R P08069 10/20 0.61
▸ ERBB2 P04626 9/20 0.61
▸ CYP2D6 P10635 1/20 0.61
▸ ERBB4 Q15303 4/20 0.60
▸ ERBB3 P21860 3/20 0.60
▸ SRC P12931 10/20 0.50
▸ KDR P35968 4/20 0.50
▸ ABL1 P00519 2/20 0.50
▸ HCK P08631 2/20 0.50
▸ PIK3CD O00329 1/20 0.50
▸ PIK3CA P42336 1/20 0.50
▸ PIK3CB P42338 1/20 0.50
▸ MTOR P42345 1/20 0.50
▸ PIK3CG P48736 1/20 0.50
▸ EPHB4 P54760 1/20 0.50
▸ PRKDC P78527 1/20 0.50
▸ LCK P06239 7/20 0.48
▸ TEK Q02763 6/20 0.48
▸ FYN P06241 2/20 0.48

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
SCHEMBL2954052 1.00 EGFR (0.61) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2957797 1.00 EGFR (0.61) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2955893 0.92 IGF1R (0.61) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2965358 0.92 IGF1R (0.52) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2961198 0.92 EGFR (0.56) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2953705 0.91 IGF1R (0.52) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2953703 0.91 IGF1R (0.52) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2953986 0.91 IGF1R (0.52) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2958145 0.90 IGF1R (0.53) EGFRIGF1RERBB2CYP2D6ERBB4
SCHEMBL2956065 0.90 IGF1R (0.53) EGFRIGF1RERBB2CYP2D6ERBB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1973917-B1 PROTEIN KINASE INHIBITORS ABBVIE INC (US) 2015-06-10 — — EP claimed
US-7772231-B2 Substituted pyrazolo[3,4-d]pyrimidines as protein kinase inhibitors ABBOTT LABORATORIES (US) 2010-08-10 — — US claimed
EP-1973917-B1 PROTEIN KINASE INHIBITORS ABBVIE INC (US) 2015-06-10 — — EP disclosed
US-7772231-B2 Substituted pyrazolo[3,4-d]pyrimidines as protein kinase inhibitors ABBOTT LABORATORIES (US) 2010-08-10 — — US disclosed
US-20070203143-A1 PROTEIN KINASE INHIBITORS ABBVIE INC. 2007-08-30 — — 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-20070203143-A1 PROTEIN KINASE INHIBITORS PACSIN2, MAP3K20, PHKG1 EGFR 591/4885IGF1R 1941/4885ERBB2 270/4885

“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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