SCHEMBL16320882

SCHEMBL16320882

CCN(C(=O)O)C1CCCC(=O)C1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
THRB P10828 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TSHR P16473 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.32
ATM Q13315 1/20 0.32
HSD11B1 P28845 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL15309551 0.82 CYP3A4 (0.33) THRBMEN1KMT2ACYP3A4CYP2C9
SCHEMBL16322241 0.80 CCR5 (0.37) L3MBTL1THRBMEN1KMT2ACYP3A4
SCHEMBL967276 0.80 L3MBTL1 (0.49) L3MBTL1MEN1KMT2ASLC6A2SLC6A4
SCHEMBL562409 0.78 AGER (0.48) L3MBTL1MEN1KMT2ACYP3A4CYP2C9
SCHEMBL970095 0.78 L3MBTL1 (0.51) L3MBTL1MEN1KMT2ASLC6A2SLC6A4
SCHEMBL967635 0.76 L3MBTL1 (0.54) L3MBTL1MEN1KMT2ATSHRSLC6A2
SCHEMBL9993822 0.75 THRB (0.38) THRBCYP3A4CYP2C9CYP2C19MAPT
SCHEMBL967470 0.73
SCHEMBL1658062 0.73 THRB (0.37) THRBCYP3A4CYP2C9CYP2C19MAPT
SCHEMBL18244677 0.73 THRB (0.37) THRBCYP3A4CYP2C9CYP2C19MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9890139-B2 CYP17 inhibitors/antiandrogens ORION CORPORATION (FI) 2018-02-13 US disclosed
US-20160130254-A1 NOVEL CYP17 INHIBITORS/ANTIANDROGENS ORION CORPORATION (FI) 2016-05-12 US disclosed
EP-3008042-A1 NOVEL CYP17 INHIBITORS/ANTIANDROGENS Orion Corporation (FI) 2016-04-20 EP disclosed
WO-2014202827-A1 NOVEL CYP17 INHIBITORS/ANTIANDROGENS ORION CORPORATION (FI) 2014-12-24 WO 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-20160130254-A1 NOVEL CYP17 INHIBITORS/ANTIANDROGENS CYP17A1, CYP19A1, CYP21A2 L3MBTL1 1418/4885THRB 494/4885MEN1 1462/4885

“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.