SCHEMBL8852211

SCHEMBL8852211

BCC(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 6/20 0.52
▸ TAAR1 Q96RJ0 1/20 0.52
▸ HRH1 P35367 5/20 0.48
▸ LMNA P02545 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.44
▸ DPP4 P27487 2/20 0.43
▸ F2 P00734 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ CHRNB2 P17787 1/20 0.42
▸ CHRNA4 P43681 1/20 0.42
▸ MTOR P42345 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ GRM7 Q14831 1/20 0.42

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
SCHEMBL12329374 0.77 HRH1 (0.56) HTR2ATAAR1HRH1LMNATDP1
SCHEMBL31439740 0.75 LMNA (0.65) TAAR1LMNARAB9A
SCHEMBL13715906 0.75 TAAR1 (0.58) TAAR1LMNA
SCHEMBL3290730 0.73 HRH1 (0.68) HTR2ATAAR1HRH1LMNATDP1
SCHEMBL9838705 0.73 HTR2A (0.58) HTR2ATAAR1HRH1TDP1DPP4
SCHEMBL2732016 0.71 HRH1 (0.65) HTR2ATAAR1HRH1LMNATDP1
SCHEMBL844862 0.71 HRH1 (0.65) HTR2ATAAR1HRH1LMNATDP1
SCHEMBL38652540 0.71 HTR2A (0.89) HTR2ATAAR1HRH1DPP4F2
SCHEMBL7800345 0.69 CA12 (0.47) HTR2ATAAR1HRH1LMNATDP1
SCHEMBL29280865 0.69 HRH1 (0.54) HTR2ATAAR1HRH1LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210130380-A1 PHOSPHONIUM ION CHANNEL BLOCKERS AND METHODS FOR USE Nocion Therapeutics, Inc. 2021-05-06 — — US disclosed
US-5594079-A COORDINATION CATALYST CONTAINING BORON, STEREOREGULAR POLYPROPYLENE TOSOH CORPORATION (JP) 1997-01-14 — — US disclosed
EP-0582278-A2 Method for producing a polyolefin TOSOH CORPORATION (JP) 1994-02-09 — — EP 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-20210130380-A1 PHOSPHONIUM ION CHANNEL BLOCKERS AND METHODS FOR USE TRPV1, TRPV5, TRPA1 HTR2A 3066/4885TAAR1 1018/4885HRH1 198/4885

“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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