SCHEMBL24913640

SCHEMBL24913640

COc1cc(N2CCN(C(=O)N[C@@H](C)c3cccc4ccccc34)CC2)ccc1-n1cnc(C)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIT P10721 2/20 0.48
PSEN1 P49768 13/20 0.46
PSEN2 P49810 13/20 0.46
APH1B Q8WW43 13/20 0.46
NCSTN Q92542 13/20 0.46
APH1A Q96BI3 13/20 0.46
PSENEN Q9NZ42 13/20 0.46
GPR142 Q7Z601 1/20 0.45
ROCK2 O75116 2/20 0.42
ROCK1 Q13464 1/20 0.42
KCNH2 Q12809 3/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL12907952 1.00 KIT (0.48) KITPSEN1PSEN2APH1BNCSTN
SCHEMBL6855102 0.82 PSEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL24913716 0.79 KIT (0.46) KITROCK2ROCK1MEN1KMT2A
SCHEMBL12944062 0.79 ROCK2 (0.51) KITROCK2ROCK1MEN1KMT2A
SCHEMBL12943942 0.76 KIT (0.49) KITROCK2MEN1KMT2A
SCHEMBL12944288 0.73 KIT (0.48) KIT
SCHEMBL12943967 0.72 ROCK2 (0.49) KITPSEN1PSEN2APH1BNCSTN
SCHEMBL12943969 0.72 KIT (0.53) KIT
SCHEMBL12944610 0.71 KIT (0.53) KIT
SCHEMBL12944259 0.71 KIT (0.38) KITROCK2ROCK1

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-20230029372-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR PREVENTION AND TREATMENT OF DIASTOLIC DYSFUNCTION Ambetex Pty Ltd (AU) 2023-01-26 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-20230029372-A1 THERAPEUTIC COMPOSITIONS AND METHODS FOR PREVENTION AND TREATMENT OF DIASTOLIC DYSFUNCTION TNNI3, TNNT2, TNNC1 KIT 4153/4885PSEN1 15/4885PSEN2 26/4885

“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.