SCHEMBL20397902

SCHEMBL20397902

CC(F)(F)c1ccc(C[C@@H](C#N)NC(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSC P53634 7/20 0.48
CTSL P07711 10/20 0.47
CTSK P43235 2/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CTSH P09668 1/20 0.46
CYP2D6 P10635 1/20 0.46
CTSB P07858 2/20 0.42
CTSF Q9UBX1 2/20 0.42
ACACB O00763 1/20 0.41

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
SCHEMBL20397904 1.00 CTSC (0.48) CTSCCTSLCTSKCYP1A2CYP3A4
SCHEMBL20397591 0.89 CTSL (0.54) CTSCCTSLCTSKCYP1A2CYP3A4
SCHEMBL20397593 0.89 CTSL (0.54) CTSCCTSLCTSKCYP1A2CYP3A4
SCHEMBL18262731 0.87 CTSC (0.49) CTSCCTSLCTSKCYP1A2CYP3A4
SCHEMBL18262732 0.87 CTSC (0.49) CTSCCTSLCTSKCYP1A2CYP3A4
SCHEMBL20415723 0.84 CTSK (0.51) CTSCCTSLCTSKCTSB
SCHEMBL4425402 0.79 CTSC (0.71) CTSCCTSLCTSKCYP1A2CYP3A4
SCHEMBL5906582 0.79 CTSC (0.71) CTSCCTSLCTSKCYP1A2CYP3A4
SCHEMBL18262781 0.78 CTSC (0.54) CTSCCTSLCTSKCYP1A2CYP3A4
SCHEMBL18262784 0.78 CTSC (0.54) CTSCCTSLCTSKCYP1A2CYP3A4

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-10858314-B2 Urea derivative or pharmacologically acceptable salt thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 2020-12-08 US disclosed
EP-3303284-B1 UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KYORIN SEIYAKU KK (JP) 2020-04-08 EP disclosed
US-20180208552-A1 UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KYORIN PHARMACEUTICAL CO., LTD. (JP) 2018-07-26 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 (2 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-10858314-B2 Urea derivative or pharmacologically acceptable salt thereof FPR1, SAAL1, FPR2 CTSC 2272/4885CTSL 157/4885CTSK 2965/4885
US-20180208552-A1 UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF FPR1, FPR2, SAAL1 CTSC 2195/4885CTSL 143/4885CTSK 2892/4885

“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.