SCHEMBL18099760

SCHEMBL18099760

Cc1ccc(COc2cc(F)cc(Oc3ccc(-c4nc([C@H]5C[C@@H](N6CCN(C)CC6)C5)n5ccnc(N)c45)cc3)c2)s1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TNK2 Q07912 9/20 0.66
▸ BTK Q06187 2/20 0.59
▸ IGF1R P08069 9/20 0.54
▸ CYP3A4 P08684 1/20 0.51
▸ MAPK3 P27361 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ MAPK6 Q16659 1/20 0.51

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
SCHEMBL16748832 0.91 TNK2 (0.65) TNK2BTKIGF1RCYP3A4MAPK3
SCHEMBL18099755 0.89 BTK (0.65) TNK2BTK
SCHEMBL18099753 0.88 TNK2 (0.64) TNK2BTK
SCHEMBL18099757 0.87 TNK2 (0.64) TNK2BTK
SCHEMBL18099754 0.87 TNK2 (0.62) TNK2BTK
SCHEMBL18099759 0.87 BTK (0.62) TNK2BTK
SCHEMBL16748939 0.84 TNK2 (0.65) TNK2BTKIGF1RCYP3A4MAPK3
SCHEMBL18099756 0.84 BTK (0.59) TNK2BTK
SCHEMBL18099752 0.82 TNK2 (0.59) TNK2BTK
SCHEMBL16748846 0.81 BTK (0.76) TNK2BTKIGF1RCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822120-B2 Protein kinase inhibitors PHARMASCIENCE INC. (CA) 2017-11-21 — — US disclosed
US-20160280711-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2016-09-29 — — 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-20160280711-A1 Protein Kinase Inhibitors TEC, LCK, SRC TNK2 43/4885BTK 8/4885IGF1R 1739/4885

“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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