SCHEMBL22639199

SCHEMBL22639199

CC(C)c1cc(CC(C)c2ncccc2Cl)ccn1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PNMT P11086 2/20 0.36
▸ NR3C2 P08235 2/20 0.34
▸ HTR2A P28223 2/20 0.33
▸ HTR2C P28335 2/20 0.33
▸ HTR2B P41595 2/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ S1PR3 Q99500 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
SCHEMBL23843301 0.83 NR3C2 (0.34) NR3C2CYP2D6HRH1
SCHEMBL19346224 0.80 TRPM8 (0.36) NR3C2HTR2AHTR2CHTR2B
SCHEMBL19227962 0.75 NR3C2 (0.56) NR3C2HTR2AHTR2CHTR2B
SCHEMBL25744955 0.74 HTR2A (0.33) PNMTNR3C2HTR2AHTR2CHTR2B
SCHEMBL12120626 0.73 GABRA1 (0.40) PNMTNR3C2HTR2AHTR2CHTR2B
SCHEMBL20694181 0.73 NR3C2 (0.42) NR3C2CYP2D6
SCHEMBL1690313 0.73 CYP2D6 (0.40) PNMTCYP2D6HRH1S1PR3
SCHEMBL23982943 0.72 CYP2D6 (0.39) PNMTHTR2AHTR2CHTR2BCYP2D6
SCHEMBL22844051 0.72 NR3C2 (0.43) NR3C2HTR2AHTR2CHTR2B
SCHEMBL22639289 0.71 ESR1 (0.36) NR3C2CYP2D6HRH1

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-10829485-B2 ATF6 inhibitors and uses thereof BLACK BELT TX LTD (GB) 2020-11-10 — — 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-10829485-B2 ATF6 inhibitors and uses thereof ATF4, XBP1, ATF1 PNMT 3274/4885NR3C2 1808/4885HTR2A 4707/4885

“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.

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