SCHEMBL23917416

SCHEMBL23917416

Nc1ncnn2c(C3Cc4ccccc4C3)nc(-c3cc(O)c(F)c(F)c3)c12

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.53
▸ BTK Q06187 1/20 0.53
▸ TNK2 Q07912 16/20 0.53
▸ IGF1R P08069 3/20 0.46
▸ INSR P06213 2/20 0.45

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
SCHEMBL16665719 0.86 PIK3CD (0.53) PIK3CDBTKTNK2IGF1RINSR
SCHEMBL16655780 0.82 TNK2 (0.55) PIK3CDBTKTNK2IGF1R
SCHEMBL16655468 0.81 ACVRL1 (0.53) PIK3CDBTK
SCHEMBL16665715 0.80 PIK3CD (0.54) PIK3CDBTKTNK2IGF1R
SCHEMBL16665724 0.77 TNK2 (0.53) TNK2IGF1RINSR
SCHEMBL16665725 0.72 PIK3CD (0.55) PIK3CDBTKTNK2IGF1R
SCHEMBL16665716 0.71 PIK3CD (0.51) PIK3CDBTKTNK2IGF1R
SCHEMBL8240001 0.69 TNK2 (0.83) TNK2IGF1R
SCHEMBL16655677 0.69 PIK3CD (1.00) PIK3CDBTK
SCHEMBL4353507 0.69 TNK2 (1.00) TNK2IGF1R

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-20210317140-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2021-10-14 — — 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-20210317140-A1 Heterocyclic Compounds and Methods of Use BTK, PIK3CD, PIK3CB PIK3CD 2/4885BTK 1/4885TNK2 70/4885

“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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