SCHEMBL26328332

SCHEMBL26328332

Cc1cccc([C@@H]2C[C@@H]2C(=O)N2CCN(c3cc(C)ccc3C)CC2)c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.65
TSHR P16473 4/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
SIGMAR1 Q99720 1/20 0.52
LMNA P02545 5/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.50
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
HRH3 Q9Y5N1 4/20 0.47

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
SCHEMBL26327882 1.00 AR (0.65) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL26327890 1.00 AR (0.65) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL18069683 0.92 AR (0.78) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL26327915 0.91 AR (0.72) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL20673550 0.91 AR (0.72) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL26328333 0.91 AR (0.72) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL26328340 0.89 AR (0.69) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL26327879 0.89 AR (0.69) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL26328366 0.89 AR (0.69) ARTSHRMEN1KMT2ASIGMAR1
SCHEMBL23549964 0.88 AR (0.57) ARTSHRMEN1KMT2ASIGMAR1

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-11766433-B2 Small molecule inhibitors of the nuclear translocation of androgen receptor for the treatment of castration-resistant prostate cancer UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2023-09-26 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-11766433-B2 Small molecule inhibitors of the nuclear translocation of androgen receptor for the treatment of castration-resistant prostate cancer AR, NR0B1, NCOA3 AR 1/4885TSHR 252/4885MEN1 3572/4885

“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.