SCHEMBL22537210

SCHEMBL22537210

COc1ccc(CNS(=O)(=O)CCCO)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 1/20 0.54
▸ TP53 P04637 1/20 0.52
▸ TAS1R3 Q7RTX0 2/20 0.46
▸ TAS1R1 Q7RTX1 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42

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
SCHEMBL20530830 0.87 APLNR (0.54) APLNRTP53TAS1R3TAS1R1ALDH1A1
SCHEMBL11300017 0.87 TP53 (0.55) APLNRTP53ALDH1A1TSHRNPSR1
SCHEMBL28970344 0.85 APLNR (0.58) APLNRTP53ALDH1A1TSHRSMN1; SMN2
SCHEMBL28452492 0.83 APLNR (0.63) APLNRTP53TAS1R3TAS1R1ALDH1A1
SCHEMBL22537209 0.82 APLNR (0.57) APLNRTP53ALDH1A1TSHRSMN1; SMN2
SCHEMBL12494088 0.81 APLNR (0.52) APLNRTP53TAS1R3TAS1R1ALDH1A1
SCHEMBL11954292 0.80 TP53 (0.46) APLNRTP53SMN1; SMN2MEN1KMT2A
SCHEMBL12492811 0.80 ALDH1A1 (0.53) APLNRTP53TAS1R3TAS1R1ALDH1A1
SCHEMBL21827126 0.79 APLNR (0.54) APLNRTP53TAS1R3TAS1R1ALDH1A1
SCHEMBL1530735 0.79 APLNR (0.65) APLNRTP53ALDH1A1TSHRSMN1; SMN2

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-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 — — EP disclosed
Send feedback