SCHEMBL20768281

SCHEMBL20768281

N#CC1(NC(=O)[C@@H]2C[C@@H](C(F)(F)c3ccc(Br)cc3C(F)(F)F)CN2C(=O)C2(C(F)(F)F)CC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.54

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
SCHEMBL20768306 1.00 CTSS (0.54) CTSS
SCHEMBL20768327 0.90 CTSL (0.44) CTSS
SCHEMBL20768282 0.88 CTSS (0.53) CTSS
SCHEMBL20768304 0.86 CTSS (0.51) CTSS
SCHEMBL19301958 0.85 CTSS (0.54) CTSS
SCHEMBL29417439 0.85 CTSS (0.54) CTSS
SCHEMBL20786605 0.84 CTSS (0.35) CTSS
SCHEMBL20786667 0.84 CTSS (0.35) CTSS
SCHEMBL29417488 0.83 CTSS (0.76) CTSS
SCHEMBL696835 0.83 CTSS (0.76) CTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111574422-A Phenyl difluoromethyl substituted prolyl compounds 安斯泰来制药株式会社 2020-08-25 CN disclosed
CN-110248925-B Phenyl difluoromethyl substituted prolyl compounds 安斯泰来制药株式会社 2020-07-17 CN disclosed
US-20190248738-A1 PHENYLDIFLUOROMETHYL-SUBSTITUTED PROLINAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2019-08-15 US disclosed
US-20190248738-A1 PHENYLDIFLUOROMETHYL-SUBSTITUTED PROLINAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2019-08-15 US disclosed
US-10322997-B2 Phenyldifluoromethyl-substituted prolinamide compound ASTELLAS PHARMA INC. (JP) 2019-06-18 US disclosed
US-10322997-B2 Phenyldifluoromethyl-substituted prolinamide compound ASTELLAS PHARMA INC. (JP) 2019-06-18 US disclosed
US-20190071398-A1 PHENYLDIFLUOROMETHYL-SUBSTITUTED PROLINAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2019-03-07 US disclosed
US-20190071398-A1 PHENYLDIFLUOROMETHYL-SUBSTITUTED PROLINAMIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2019-03-07 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 (3 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-20190248738-A1 PHENYLDIFLUOROMETHYL-SUBSTITUTED PROLINAMIDE COMPOUND CTSV, CTSS, CTSF CTSS 2/4885
US-10322997-B2 Phenyldifluoromethyl-substituted prolinamide compound CTSV, CTSS, CTSF CTSS 2/4885
US-20190071398-A1 PHENYLDIFLUOROMETHYL-SUBSTITUTED PROLINAMIDE COMPOUND CTSS, CTSV, CTSF CTSS 1/4885

“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.