SCHEMBL21751965

SCHEMBL21751965

CCc1c[nH]cc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.54
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 2/20 0.43
GABRP O00591 2/20 0.41
GABRD O14764 2/20 0.41
GABRA1 P14867 2/20 0.41
GABRB1 P18505 2/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRA3 P34903 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 2/20 0.41
GABRA4 P48169 2/20 0.41
GABRE P78334 2/20 0.41
GABRA6 Q16445 2/20 0.41
GABRG1 Q8N1C3 2/20 0.41
GABRG3 Q99928 2/20 0.41
GABRQ Q9UN88 2/20 0.41
CLCN2 P51788 2/20 0.38

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
SCHEMBL969678 0.85 NOTUM (0.48) NOTUMALDH1A1KMT2AGABRPGABRD
SCHEMBL27847809 0.79 HSP90AB1 (0.39) NOTUMALDH1A1KMT2ASMN1; SMN2KDM4E
SCHEMBL1126724 0.79 NOTUM (0.47) NOTUMALDH1A1KMT2AGABRA1GABRB2
SCHEMBL5842251 0.77 NOTUM (0.45) NOTUMALDH1A1KMT2AALOX15CYP1A2
SCHEMBL70047 0.76 NOTUM (0.65) NOTUMALDH1A1KMT2AALOX15CYP1A2
SCHEMBL1156440 0.76 NR4A2 (0.41) ALDH1A1KMT2AKDM4ETSHRHSD17B10
SCHEMBL4046233 0.74 TSHR (0.53) ALDH1A1KMT2AGABRA1GABRB2ALOX15
SCHEMBL23674857 0.73 GABRP (0.40) NOTUMALDH1A1KMT2AGABRPGABRD
SCHEMBL4116012 0.72 GABRP (0.50) ALDH1A1GABRPGABRDGABRA1GABRB1
SCHEMBL2334997 0.72 GABRP (0.55) ALDH1A1GABRPGABRDGABRA1GABRB1

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
WO-2020040851-A1 A PROCESS FOR FORMING AN ELECTROLYTIC CAPACITOR HAVING A HIGHER CAP RECOVERY AND LOWER ESR KEMET ELECTRONICS CORPORATION (US) 2020-02-27 WO claimed