SCHEMBL23095484

SCHEMBL23095484

CC(C)c1ccc(C(C)(C)c2ccc(C(C)(C)c3cccc(Cl)c3Cl)c(F)c2)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.36
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
NFKB1 P19838 1/20 0.31
PNMT P11086 1/20 0.31
RORC P51449 1/20 0.31
P2RX7 Q99572 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GLA P06280 1/20 0.31

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
SCHEMBL22863819 0.80 PDE2A (0.42) PDE2ACYP3A4ALDH1A1LMNA
SCHEMBL18647493 0.76 PDE2A (0.43) PDE2ARORCLMNA
SCHEMBL24772476 0.73 PDE2A (0.58) PDE2AALDH1A1
SCHEMBL19805986 0.73 PDE2A (0.41) PDE2APNMTRORCALDH1A1LMNA
SCHEMBL23489786 0.73 CYP2D6 (0.33) PDE2ACYP2D6
SCHEMBL24696003 0.72 PDE2A (0.34) PDE2A
SCHEMBL18559007 0.71 PDE2A (0.36) PDE2ARORC
SCHEMBL21146831 0.71 PDE2A (0.40) PDE2ARORC
SCHEMBL19374773 0.71 NR3C1 (0.30)
SCHEMBL19121188 0.68 PDE2A (0.37) PDE2ACYP1A2CYP3A4CYP2D6RORC

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-10947260-B2 Phosphinolactone derivatives and pharmaceutical uses thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2021-03-16 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-10947260-B2 Phosphinolactone derivatives and pharmaceutical uses thereof PHOSPHO1, PSEN1, PSEN2 PDE2A 1688/4885CYP1A2 1220/4885CYP3A4 1150/4885

“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.