SCHEMBL12176200

SCHEMBL12176200

Cc1cccc(C)c1C(=O)N1CCC[C@H](C(=O)Nc2cccc(OC(F)(F)F)c2)[C@@H]1c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 19/20 0.52
▸ KLK7 P49862 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ PTGS1 P23219 1/20 0.48
▸ HCRTR1 O43613 1/20 0.47
▸ HCRTR2 O43614 1/20 0.47

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
SCHEMBL12176203 0.88 NPSR1 (0.44) CYP2C9
SCHEMBL14960484 0.87 UBE2M (0.51) HCRTR1HCRTR2
SCHEMBL18790110 0.87 UBE2M (0.51) HCRTR1HCRTR2
SCHEMBL13326991 0.87 UBE2M (0.51) HCRTR1HCRTR2
SCHEMBL12176516 0.86 CFD (0.46) CFDKLK7ADORA3CYP2C9PTGS1
SCHEMBL14959021 0.85 ALDH1A1 (0.56) CYP2C9
SCHEMBL18609476 0.85 ALDH1A1 (0.45) CYP2C9
SCHEMBL14959038 0.85 ALDH1A1 (0.45) CYP2C9
SCHEMBL12176191 0.84 ALDH1A1 (0.43) CYP2C9
SCHEMBL18532606 0.84 ALDH1A1 (0.43) CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230102258-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2023-03-30 — — US disclosed
US-20170114017-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2017-04-27 — — US disclosed
US-9573897-B2 C5AR antagonists CHEMOCENTRYX, INC. (US) 2017-02-21 — — US disclosed
US-20160229802-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2016-08-11 — — US disclosed
US-9126939-B2 C5AR antagonists CHEMOCENTRYX, INC. 2015-09-08 — — US disclosed
US-20130172347-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2013-07-04 — — US disclosed
US-20110275639-A1 C5aR ANTAGONISTS CHEMOCENTRYX, INC. (US) 2011-11-10 — — 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 (5 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-20110275639-A1 C5aR ANTAGONISTS C5AR1, C5AR2, C3AR1 CFD 24/4885KLK7 2693/4885ADORA3 121/4885
US-20170114017-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 CFD 24/4885KLK7 2693/4885ADORA3 121/4885
US-20160229802-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 CFD 24/4885KLK7 2693/4885ADORA3 121/4885
US-20230102258-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 CFD 24/4885KLK7 2693/4885ADORA3 121/4885
US-20130172347-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 CFD 24/4885KLK7 2693/4885ADORA3 121/4885

“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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