SCHEMBL29954881

SCHEMBL29954881

CS(=O)(=O)c1ccccc1N1CCC(C(=O)O)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.52
DRD2 P14416 2/20 0.52
APAF1 O14727 1/20 0.47
NSD2 O96028 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
CASP3 P42574 1/20 0.47
RECQL P46063 1/20 0.47
GALK1 P51570 1/20 0.47
KMT2A Q03164 1/20 0.47
HKDC1 Q2TB90 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
KDM4E B2RXH2 2/20 0.45
CYP2C19 P33261 1/20 0.45
EED O75530 1/20 0.44

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
SCHEMBL22807129 0.87 DRD2 (0.47) NOTUMDRD2APAF1NSD2POLB
SCHEMBL2557896 0.85 NOTUM (0.52) NOTUMAPAF1NSD2POLBMAPT
SCHEMBL29956491 0.83 NOTUM (0.55) NOTUMDRD2MAPTKMT2AKDM4E
SCHEMBL3436316 0.78 TSHR (0.58) NOTUMMAPTKDM4ECYP2C19ALDH1A1
SCHEMBL5800932 0.78 NOTUM (0.81) NOTUMAPAF1NSD2POLBMAPT
SCHEMBL2555349 0.77 NOTUM (0.65) NOTUM
SCHEMBL5798505 0.77 CASP1 (0.58) NOTUMAPAF1NSD2POLBMAPT
SCHEMBL29957383 0.77 NOTUM (0.60) NOTUM
SCHEMBL4825361 0.76 DRD2 (0.62) DRD2MAPTCYP2C19EEDALDH1A1
SCHEMBL5800091 0.75 NOTUM (0.58) NOTUMAPAF1NSD2POLBMAPT

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed