SCHEMBL8969916

SCHEMBL8969916

CO[C@H]1CCC[C@@H]1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.41
MEN1 O00255 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
ACE P12821 1/20 0.37
CYP2C19 P33261 1/20 0.36
PPM1B O75688 1/20 0.34
PTPN1 P18031 1/20 0.34
PPP1CC P36873 1/20 0.34
KDM4E B2RXH2 2/20 0.34
TSHR P16473 1/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL8086372 1.00 PEPD (0.41) PEPDMEN1BLMKMT2AACE
SCHEMBL8969423 1.00 PEPD (0.41) PEPDMEN1BLMKMT2AACE
Hydrochloric Acid SCHEMBL8970160 0.98 PEPD (0.44) PEPDMEN1BLMKMT2AACE
Hydrochloric Acid SCHEMBL8970089 0.98 PEPD (0.44) PEPDMEN1BLMKMT2AACE
SCHEMBL8072246 0.95 CYP2C19 (0.39) PEPDMEN1BLMKMT2ACYP2C19
SCHEMBL8970243 0.95 CYP2C19 (0.39) PEPDMEN1BLMKMT2ACYP2C19
SCHEMBL8970358 0.93 CYP2C19 (0.38) PEPDMEN1BLMKMT2ACYP2C19
Hydrochloric Acid SCHEMBL8970750 0.93 PEPD (0.39) PEPDMEN1BLMKMT2ACYP2C19
SCHEMBL8969963 0.93 CYP2C19 (0.38) PEPDMEN1BLMKMT2ACYP2C19
SCHEMBL10998711 0.85 ACE (0.38) PEPDMEN1BLMKMT2AACE

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