SCHEMBL5498032

SCHEMBL5498032

C1CC[C@H]2CCCC[C@H]2C1.C1CC[C@H]2CCCC[C@H]2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 1.00
THRB P10828 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.39
SLC18A3 Q16572 2/20 0.35
HSD17B10 Q99714 1/20 0.33
NOS3 P29474 3/20 0.32
NOS1 P29475 3/20 0.32
NOS2 P35228 3/20 0.32
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
SCHEMBL22724 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL11230 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL5497317 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL2074366 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL308940 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL296805 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL10943225 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL307406 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL9869925 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR
SCHEMBL9870407 1.00 ALDH1A1 (1.00) ALDH1A1THRBMEN1KMT2ATSHR

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-20070078080-A1 N4-Acylcytosine Nucleosides for Treatment of Viral Infections GILEAD PHARMASSET LLC 2007-04-05 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-20070078080-A1 N4-Acylcytosine Nucleosides for Treatment of Viral Infections ENTPD5, DUT, NT5C3B ALDH1A1 2325/4885THRB 3646/4885MEN1 4561/4885

“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.