SCHEMBL4230867

SCHEMBL4230867

FC(F)(F)CCc1cccs1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.54
▸ ADRA2A P08913 3/20 0.44
▸ ADRA2B P18089 3/20 0.44
▸ ADRA2C P18825 3/20 0.44
▸ PTGS1 P23219 1/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ CYP2C19 P33261 1/20 0.38
▸ SLC6A3 Q01959 2/20 0.38
▸ POLB P06746 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ HRH3 Q9Y5N1 2/20 0.37
▸ RIPK1 Q13546 1/20 0.37

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
SCHEMBL5806103 0.88 TAAR1 (0.55) TAAR1ADRA2AADRA2BADRA2CPTGS1
SCHEMBL2032117 0.86 TAAR1 (0.53) TAAR1ADRA2AADRA2BADRA2CPTGS1
SCHEMBL9724105 0.84 TAAR1 (0.52) TAAR1ADRA2AADRA2BADRA2CPTGS1
SCHEMBL418868 0.78 TAAR1 (0.54) TAAR1ADRA2AADRA2BADRA2CPTGS1
SCHEMBL2030841 0.78 TAAR1 (0.71) TAAR1ADRA2AADRA2BADRA2CPTGS1
SCHEMBL10913191 0.77 TAAR1 (0.44) TAAR1ADRA2AADRA2BADRA2CPTGS1
SCHEMBL10917322 0.77 TAAR1 (0.44) TAAR1ADRA2AADRA2BADRA2CPTGS1
SCHEMBL5029219 0.77 TAAR1 (0.46) TAAR1ADRA2AADRA2BADRA2CSMN1; SMN2
SCHEMBL28505470 0.76 TAAR1 (0.52) TAAR1ADRA2AADRA2BADRA2CPTGS1
SCHEMBL4476863 0.75 TAAR1 (0.50) TAAR1ADRA2AADRA2BADRA2CPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108658989-B Preparation method and application of cangrelor intermediate 一禾(湖州)生物医药科技有限公司 2022-04-08 — — CN disclosed
US-20090320718-A1 FLUOROSURFACTANTS MERCK PATENT GESELLSCHAFT (DE) 2009-12-31 — — US disclosed
EP-2035132-A2 FLUOROSURFACTANTS MERCK PATENT GmbH (DE) 2009-03-18 — — EP disclosed
WO-2008003447-A2 FLUOROSURFACTANTS MERCK PATENT GMBH (DE) 2008-01-10 — — WO 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-20090320718-A1 FLUOROSURFACTANTS FPR3, Q6ZSR9, SGMS2 TAAR1 2143/4885ADRA2A 1829/4885ADRA2B 2890/4885

“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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