SCHEMBL26762014

SCHEMBL26762014

CC(C)c1cc(OC(F)F)c2ncc(Br)cc2c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.33
GRIN1 Q05586 3/20 0.33
GRIN2B Q13224 3/20 0.33
MET P08581 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL25113804 0.84 CCR1 (0.40) RXRAGRIN1GRIN2B
SCHEMBL26762020 0.84 ALDH1A1 (0.40) NPC1RAB9A
SCHEMBL26762016 0.77 ALDH1A1 (0.34)
SCHEMBL23905520 0.77 CCR1 (0.41) RXRAGRIN1GRIN2B
SCHEMBL26762031 0.71 PDE10A (0.33) RXRAGRIN1GRIN2B
SCHEMBL21585394 0.68 RXRA (0.38) RXRAGRIN1GRIN2BMETNPC1
SCHEMBL16648664 0.66 RXRA (0.34) RXRAGRIN1GRIN2BMETNPC1
SCHEMBL189205 0.66 PIK3CA (0.37) RXRAGRIN1GRIN2BMET
SCHEMBL10141672 0.66 MAP3K12 (0.45)
SCHEMBL23905240 0.66 P2RX3 (0.38)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365525-A1 ANTIVIRAL COMPOUNDS ENANTA PHARMACEUTICALS, INC. 2023-11-16 US disclosed
US-20230365525-A1 ANTIVIRAL COMPOUNDS ENANTA PHARMACEUTICALS, INC. 2023-11-16 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-20230365525-A1 ANTIVIRAL COMPOUNDS ACE, ZC3HAV1, SARS1 RXRA 2401/4885GRIN1 3700/4885GRIN2B 4162/4885

“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.