SCHEMBL12066463

SCHEMBL12066463

CCN(CC)[C@@H](C=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.42
HRH1 P35367 3/20 0.42
PGR P06401 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
KCNH2 Q12809 1/20 0.42
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
LMNA P02545 3/20 0.38
MAPT P10636 3/20 0.38
OPRD1 P41143 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP1A2 P05177 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
CYP3A4 P08684 1/20 0.36
KCNA5 P22460 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL3344466 1.00 HTR2A (0.42) HTR2AHRH1PGRADRA2AADRA2B
SCHEMBL903868 1.00 HTR2A (0.42) HTR2AHRH1PGRADRA2AADRA2B
SCHEMBL27758907 0.82 HTR2A (0.41) HTR2AHRH1ALDH1A1SIGMAR1LMNA
SCHEMBL27628280 0.82 SIGMAR1 (0.40) HTR2AHRH1PGRADRA2AADRA2B
SCHEMBL988241 0.80 SIGMAR1 (0.39) HTR2AHRH1PGRADRA2AADRA2B
SCHEMBL18765875 0.78 TSHR (0.39) HTR2AADRA2BKCNH2ALDH1A1MEN1
SCHEMBL18765877 0.78 TSHR (0.39) HTR2AADRA2BKCNH2ALDH1A1MEN1
SCHEMBL689805 0.77 ALDH1A1 (0.42) HTR2AHRH1ALDH1A1MEN1KMT2A
SCHEMBL12067933 0.77 ALDH1A1 (0.42) HTR2AHRH1ALDH1A1MEN1KMT2A
SCHEMBL11778053 0.76 ALDH1A1 (0.38) HTR2AHRH1ALDH1A1KMT2ALMNA

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
US-10344019-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2019-07-09 US disclosed
WO-2011150243-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2011-12-01 WO disclosed
WO-2010138488-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-12-02 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-10344019-B2 Antiviral compounds MAVS, EIF2AK2, ZC3HAV1 HTR2A 4623/4885HRH1 3197/4885PGR 4048/4885

“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.