SCHEMBL20094832

SCHEMBL20094832

CCCCCCCC(CCCCCC)N1CCC(C(C)(C)C)CC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.35
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GNAI3 P08754 2/20 0.32
GNAO1 P09471 2/20 0.32
GNAI1 P63096 2/20 0.32
FDPS P14324 3/20 0.32
LMNA P02545 1/20 0.31
HSD11B1 P28845 1/20 0.30

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
SCHEMBL20094610 0.87 FDPS (0.33) FDPSLMNA
SCHEMBL20094648 0.87 FDPS (0.33) FDPSLMNA
SCHEMBL20094594 0.87 FDPS (0.33) FDPSLMNA
SCHEMBL26530253 0.85 HRH3 (0.39) CYP2D6KCNH2HRH3MEN1KMT2A
SCHEMBL26798425 0.85 GNAI3 (0.31) GNAI3GNAO1GNAI1FDPS
SCHEMBL23733462 0.80 GNAI3 (0.38) GNAI3GNAO1GNAI1FDPSLMNA
SCHEMBL19055353 0.80 SIGMAR1 (0.35) MEN1KMT2AGNAI3GNAO1GNAI1
SCHEMBL19852565 0.80 SIGMAR1 (0.35) MEN1KMT2AGNAI3GNAO1GNAI1
SCHEMBL24599674 0.79 FDPS (0.41) FDPSLMNA
SCHEMBL14238528 0.79 FDPS (0.41) FDPSLMNA

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-20180111939-A1 7-(MORPHOLIN-4-YL)PYRAZOLE[1,5-A]PYRIMIDINE DERIVATIVES WHICH ARE USEFUL FOR THE TREATMENT OF IMMUNE OR INFALMMATORY DISEASES OR CANCER CELON PHARMA S.A. (PL) 2018-04-26 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-20180111939-A1 7-(MORPHOLIN-4-YL)PYRAZOLE[1,5-A]PYRIMIDINE DERIVATIVES WHICH ARE USEFUL FOR THE TREATMENT OF IMMUNE OR INFALMMATORY DISEASES OR CANCER AFF2, INF2, AFF1 CYP2D6 207/4885KCNH2 904/4885HRH3 378/4885

“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.