SCHEMBL25697407

SCHEMBL25697407

CC(C)c1cc(N2CCCCC2)ccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 8/20 0.54
CHKA P35790 1/20 0.46
LNPEP Q9UIQ6 1/20 0.43
ELOVL1 Q9BW60 1/20 0.43
TERT O14746 2/20 0.42
MAP4K4 O95819 1/20 0.39
KCNA5 P22460 3/20 0.39
S100B P04271 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL10774082 0.98 HRH4 (0.51) HRH4CHKALNPEPELOVL1TERT
SCHEMBL29529805 0.87 HRH4 (0.51) HRH4CHKALNPEPELOVL1TERT
SCHEMBL17998799 0.85 HRH4 (0.57) HRH4MEN1GAAMAPTMAPK1
SCHEMBL22601452 0.84 HRH4 (0.52) HRH4CHKALNPEPELOVL1TERT
SCHEMBL807537 0.83 CHEK1 (0.47) MEN1ALDH1A1LMNAMAPTALOX15
SCHEMBL23114440 0.81 CDK1 (0.45) HRH4MAPTLRRK2
SCHEMBL22601447 0.79 CHEK1 (0.50) MEN1LMNAGAAMAPTALOX15
SCHEMBL25017248 0.78 HRH4 (0.44) HRH4
SCHEMBL11960306 0.77 LRRK2 (0.45) HRH4TERTALDH1A1ALOX15HTT
SCHEMBL9455784 0.77 HRH4 (0.58) HRH4CHKALNPEPELOVL1TERT

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-20230183216-A1 PYRIDIZIN-3(2H)-ONE DERIVATIVES GILEAD SCIENCES, INC. 2023-06-15 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-20230183216-A1 PYRIDIZIN-3(2H)-ONE DERIVATIVES PIR, CYP3A43, CYP1A2 HRH4 1830/4885CHKA 2909/4885LNPEP 4220/4885

“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.