SCHEMBL24249641

SCHEMBL24249641

CCCc1ccc2ccc(C(=O)N[C@H](CC3CCCCC3)C(=O)OC)cc2c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.51
CTSS P25774 2/20 0.51
CTSK P43235 2/20 0.51
TAS1R3 Q7RTX0 4/20 0.50
TAS1R1 Q7RTX1 4/20 0.50
BDKRB2 P30411 2/20 0.44
GRN P28799 1/20 0.43
SORT1 Q99523 1/20 0.43
HTRA1 Q92743 6/20 0.42
CNR2 P34972 1/20 0.42
CTSB P07858 1/20 0.41
METAP2 P50579 1/20 0.41
METAP1 P53582 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
SCHEMBL28979552 0.85 CTSS (0.66) CTSLCTSSCTSKHTRA1CTSB
SCHEMBL29397792 0.85 CTSS (0.66) CTSLCTSSCTSKHTRA1CTSB
SCHEMBL17859965 0.85 CTSS (0.66) CTSLCTSSCTSKHTRA1CTSB
SCHEMBL1122538 0.76 BDKRB2 (0.50) CTSLCTSSTAS1R3TAS1R1BDKRB2
SCHEMBL1123215 0.75 TAS1R3 (0.53) CTSLCTSSCTSKTAS1R3TAS1R1
SCHEMBL1123156 0.75 GPR132 (0.58) CTSLCTSSCTSKBDKRB2CTSB
SCHEMBL17843413 0.73 GRN (0.62) CTSLCTSSCTSKGRNSORT1
SCHEMBL30334963 0.73 GRN (0.62) CTSLCTSSCTSKGRNSORT1
SCHEMBL17843401 0.73 GRN (0.62) CTSLCTSSCTSKGRNSORT1
SCHEMBL1123253 0.71 GPR132 (0.65) CTSLCTSSCTSKCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3472130-B1 ALIPHATIC PROLINAMIDE DERIVATIVES Orion Ophthalmology LLC (US) 2022-02-16 EP disclosed