SCHEMBL20889273

SCHEMBL20889273

CC1CCc2cccc(C(C)C(N)C(=O)O)c21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
RRM1 P23921 1/20 0.38
RRM2B Q7LG56 1/20 0.38
DRD2 P14416 2/20 0.36
ACHE P22303 2/20 0.34
DPP4 P27487 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
HTR1A P08908 3/20 0.33
ACE P12821 1/20 0.33

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
SCHEMBL19682371 1.00 CHRM2 (0.38) CHRM2CHRM1RRM1RRM2BDRD2
SCHEMBL19682361 1.00 CHRM2 (0.38) CHRM2CHRM1RRM1RRM2BDRD2
SCHEMBL20889394 0.78 CHRM2 (0.34) CHRM2CHRM1RRM1RRM2BDPP4
SCHEMBL19682374 0.78 CHRM2 (0.34) CHRM2CHRM1RRM1RRM2BDPP4
SCHEMBL20889375 0.75 ALOX5 (0.33) DRD2DPP4DPP7
SCHEMBL22507751 0.75 ALOX5 (0.33) DRD2DPP4DPP7
SCHEMBL19682598 0.75 ALOX5 (0.33) DRD2DPP4DPP7
SCHEMBL19682600 0.75 ALOX5 (0.33) DRD2DPP4DPP7
SCHEMBL19682589 0.73 BCL2L1 (0.41) CHRM2CHRM1RRM1RRM2B
SCHEMBL20889377 0.73 RXRA (0.40) CHRM2CHRM1RRM1RRM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3718545-A1 ANTITUMOR AGENT Taiho Pharmaceutical Co., Ltd. (JP) 2020-10-07 EP disclosed
EP-3466934-A1 SULFONAMIDE COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2019-04-10 EP disclosed