SCHEMBL9730369

SCHEMBL9730369

CCO[C@@H](C)[C@@H](C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
CHRM1 P11229 1/20 0.39
AKR1A1 P14550 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GABRP O00591 2/20 0.36
GABRD O14764 2/20 0.36
GABRA1 P14867 2/20 0.36
GABRB1 P18505 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36

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
SCHEMBL566390 1.00 LMNA (0.39) LMNACHRM1AKR1A1CHRM3HTR2A
Hydrochloric Acid SCHEMBL9730110 0.98 LMNA (0.38) LMNACHRM1AKR1A1CHRM3HTR2A
SCHEMBL9730213 0.81 TDP1 (0.36) LMNACHRM1AKR1A1CHRM3HTR2A
SCHEMBL13567290 0.80 LMNA (0.39) LMNATDP1GABRPGABRDGABRA1
SCHEMBL9730957 0.79 ACE2 (0.32) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL9731456 0.79 CHRM1 (0.40) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL9730337 0.78 TSHR (0.35) TP53
SCHEMBL7069046 0.78 LMNA (0.38) LMNACHRM1AKR1A1CHRM3HTR2A
SCHEMBL9730106 0.78 LMNA (0.38) LMNAGABRPGABRDGABRA1GABRB1
SCHEMBL8726284 0.78 TDP1 (0.46) LMNACHRM1AKR1A1CHRM3HTR2A

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-5167863-A Ferroelectricity; electrooptic switches HITACHI, LTD. (JP) 1992-12-01 US disclosed