SCHEMBL8970469

SCHEMBL8970469

CC(C)(C)C(=O)OC1CSCC1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.34
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL8970231 0.79 KMT2A (0.47) KMT2ANPSR1KDM4E
SCHEMBL8970183 0.78 KMT2A (0.33) KMT2ANPSR1
SCHEMBL8970359 0.78 GRM2 (0.36) GRM2
SCHEMBL8969961 0.75 CHRM2 (0.37) GRM2KMT2ANPSR1KDM4E
SCHEMBL8970043 0.75 KMT2A (0.32) GRM2KMT2ANPSR1KDM4E
SCHEMBL8969140 0.71 GRM2 (0.35) GRM2
SCHEMBL8969365 0.71 MMP1 (0.35) GRM2
SCHEMBL8970275 0.70 ALDH1A1 (0.36) GRM2
SCHEMBL20043298 0.70 GRM2 (0.33) GRM2
SCHEMBL15055464 0.68 GABRR1 (0.43) GRM2KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0376294-B1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI LTD (JP) 1996-03-13 EP disclosed
US-5370821-A Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-06 US disclosed
US-5269965-A Optically active compounds, liquid crystal compositions comprising said compounds and liquid crystal optical modulators using said compositions TAKEDA CHEMICAL INDUSTRIES (JP) 1993-12-14 US disclosed
EP-0376294-A1 Optically active compounds, liquid crystal compositions comprising said compounds, and liquid crystal optical modulators using said compositions HITACHI, LTD. (JP) 1990-07-04 EP disclosed