SCHEMBL17468366

SCHEMBL17468366

COCCN1CCN(Cc2ccc(C)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.61
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
HRH3 Q9Y5N1 3/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SIGMAR1 Q99720 1/20 0.47
ATM Q13315 1/20 0.47
CXCR4 P61073 1/20 0.46

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
SCHEMBL21637809 0.86 POLB (0.54) POLBALDH1A1LMNAKMT2AMEN1
SCHEMBL4939064 0.85 ALDH1A1 (0.52) ALDH1A1LMNAKMT2AMEN1HRH3
SCHEMBL13020890 0.85 MAPK1 (0.55) MAPK1
SCHEMBL1926621 0.85 ALDH1A1 (0.53) POLBALDH1A1LMNAKMT2AMEN1
SCHEMBL13256749 0.85 SIGMAR1 (0.68) HRH3SIGMAR1
SCHEMBL10090150 0.84 MC4R (0.65) POLBALDH1A1LMNASIGMAR1
SCHEMBL14883169 0.84 ALDH1A1 (0.54) POLBALDH1A1LMNAKMT2AMEN1
SCHEMBL11356824 0.83 LMNA (0.83) POLBALDH1A1LMNAKMT2AMEN1
SCHEMBL1045922 0.83 LMNA (0.83) POLBALDH1A1LMNAKMT2AMEN1
SCHEMBL7989530 0.83 LMNA (0.83) POLBALDH1A1LMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023096987-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2023-06-01 WO disclosed
US-9834521-B2 Choline kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2017-12-05 US disclosed
US-20160024024-A1 Novel Choline Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. 2016-01-28 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-20160024024-A1 Novel Choline Kinase Inhibitors CHKA, CHKB, CEPT1 POLB 3676/4885ALDH1A1 2140/4885LMNA 3535/4885

“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.