SCHEMBL24770534

SCHEMBL24770534

CC(C)Cn1nccc1C(C)CCC(C)c1ccnn1C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.32
MAPK1 P28482 1/20 0.32
PGR P06401 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
SCHEMBL25771142 0.78 CYP1A2 (0.36) MAPK1PGR
SCHEMBL18250270 0.77 MAPK1 (0.34) GRM2MAPK1
SCHEMBL22013190 0.75 KDM4E (0.34) MAPK1PGR
SCHEMBL19250992 0.75 CYP1A2 (0.35) MAPK1PGR
SCHEMBL25465246 0.75 CYP1A2 (0.35) MAPK1PGR
SCHEMBL15960686 0.75 CYP1A2 (0.35) MAPK1PGR
SCHEMBL24665488 0.74 CNR2 (0.33) GRM2MAPK1
SCHEMBL23219802 0.72 CYP1A2 (0.39)
SCHEMBL20374380 0.72 CYP1A2 (0.39)
SCHEMBL25867967 0.70 COMT (0.31)

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-20220389007-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2022-12-08 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-20220389007-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION EIF2AK2, POLR2E, POLR2H GRM2 4831/4885MAPK1 1795/4885PGR 3093/4885

“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.