SCHEMBL8970043

SCHEMBL8970043

COC1CSCC1C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GRM2 Q14416 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GABRR1 P24046 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
SCHEMBL8970359 0.78 GRM2 (0.36) GRM2
SCHEMBL8970016 0.78 ACE (0.32) GRM2
SCHEMBL8970275 0.78 ALDH1A1 (0.36) GRM2
SCHEMBL15055464 0.75 GABRR1 (0.43) KMT2AGRM2KDM4EGABRR1
SCHEMBL70312 0.75 GABRR1 (0.43) KMT2AGRM2KDM4EGABRR1
SCHEMBL8969140 0.75 GRM2 (0.35) GRM2
SCHEMBL8969961 0.75 CHRM2 (0.37) KMT2ANPSR1GRM2KDM4E
SCHEMBL8970469 0.75 GRM2 (0.34) KMT2ANPSR1GRM2KDM4E
SCHEMBL8972064 0.74 PPM1B (0.37) KMT2A

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