SCHEMBL10364366

SCHEMBL10364366

COC(=O)[C@@H](NC(C)CCc1ccccc1)C(O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 2/20 0.47
LMNA P02545 2/20 0.47
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
SLC6A2 P23975 1/20 0.47
HTR2A P28223 1/20 0.47
OPRM1 P35372 1/20 0.47
DRD3 P35462 1/20 0.47
OPRK1 P41145 1/20 0.47
HTR2B P41595 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KCNH2 Q12809 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL10362983 0.94 ALDH1A1 (0.48) ADRA1ALMNAADRB2ADRB1HTR1A
SCHEMBL10364816 0.92 NPSR1 (0.48) ADRA1ALMNAADRB2ADRB1HTR1A
SCHEMBL10362923 0.92 ADRA1A (0.49) ADRA1ALMNAADRB2ADRB1HTR1A
SCHEMBL10363913 0.90 ADRA1A (0.47) ADRA1ALMNAADRB2ADRB1HTR1A
SCHEMBL10363021 0.88 ADRA1A (0.46) ADRA1ALMNAADRB2ADRB1HTR1A
SCHEMBL10362958 0.87 HIF1A (0.48) ADRA1AHTR1AADRA2ASLC6A2OPRM1
SCHEMBL10362823 0.85 ADRA1A (0.43) ADRA1ALMNAADRB2ADRB1HTR1A
SCHEMBL10363098 0.84 LTA4H (0.46) ADRA1AADRB2CYP1A2CYP2C19ADRA1D
SCHEMBL10925545 0.84 SLC2A1 (0.46) LMNANPSR1SMN1; SMN2KMT2AMEN1
SCHEMBL7270994 0.84 F2 (0.48) LMNASMN1; SMN2KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0185814-B1 PHENYLSERINE DERIVATIVES AND PROCESSES FOR THEIR PREPARATION SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-08-29 EP disclosed
US-4695580-A Phenylserine derivatives and processes for preparing the same SUMITOMO PHARMACEUTICALS COMPANY, LTD. (JP) 1987-09-22 US disclosed
EP-0185814-A2 Phenylserine derivatives and processes for their preparation SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1986-07-02 EP disclosed