SCHEMBL24029307

SCHEMBL24029307

CC(C)(C)Cc1ccc(-n2cc(COC3CCCCO3)nn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.42
GRIN1 Q05586 10/20 0.42
GRIN2B Q13224 10/20 0.42
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
NPC1 O15118 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
P2RX7 Q99572 1/20 0.39
MIF P14174 1/20 0.38

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
SCHEMBL20857082 0.89 RXRA (0.48) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL20047046 0.87 RXRA (0.41) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL20047001 0.87 RXRA (0.41) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL20047076 0.87 CA1 (0.43) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL17482381 0.87 CA2 (0.43) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL19276551 0.86 RXRA (0.42) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL18818621 0.86 RXRA (0.41) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL22252456 0.85 CA1 (0.49) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL21669973 0.84 RXRA (0.40) RXRAGRIN1GRIN2BCA1CA2
SCHEMBL18818594 0.84 RXRA (0.40) RXRAGRIN1GRIN2BCA1CA2

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-20210353781-A1 SURFACE-MODIFIED CELLS, METHODS OF MAKING AND USING UNITED STATES GOVERNMENT 2021-11-18 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-20210353781-A1 SURFACE-MODIFIED CELLS, METHODS OF MAKING AND USING CD4, EPCAM, CD2 RXRA 1948/4885GRIN1 1191/4885GRIN2B 1733/4885

“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.