SCHEMBL8935305

SCHEMBL8935305

CC1=CC(=O)O[C@@H](COCc2ccccc2)C1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.57
LMNA P02545 1/20 0.53
CDC25B P30305 1/20 0.49
CYP3A4 P08684 1/20 0.48
AKT1 P31749 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
DRD1 P21728 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
TSHR P16473 1/20 0.38
HRH4 Q9H3N8 4/20 0.38
HRH3 Q9Y5N1 4/20 0.38
ACHE P22303 1/20 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
SCHEMBL8935309 1.00 PTPN1 (0.57) PTPN1LMNACDC25BCYP3A4AKT1
SCHEMBL9269173 0.83 LMNA (0.53) PTPN1LMNACDC25BCYP3A4AKT1
SCHEMBL3142790 0.81 LMNA (0.63) PTPN1LMNACDC25BAKT1L3MBTL1
SCHEMBL10439532 0.75 LMNA (0.57) PTPN1LMNACDC25BAKT1L3MBTL1
SCHEMBL9872188 0.75 LMNA (0.57) PTPN1LMNACDC25BAKT1L3MBTL1
SCHEMBL8980491 0.74 LMNA (0.56) PTPN1LMNACDC25BAKT1L3MBTL1
SCHEMBL22569916 0.74 LMNA (0.56) PTPN1LMNACDC25BCYP3A4AKT1
SCHEMBL15084444 0.74 LMNA (0.56) PTPN1LMNACDC25BCYP3A4AKT1
SCHEMBL3143177 0.74 LMNA (0.55) PTPN1LMNACDC25BAKT1L3MBTL1
SCHEMBL6282511 0.73 LMNA (0.55) PTPN1LMNACDC25BAKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4049287-A None JP disclosed
US-5504219-A Optically active compounds and intermediates thereof, and process for manufacturing same ASAHI DENKA KOGYO K.K. (JP) 1996-04-02 US disclosed
US-5352845-A Process for manufacture of optically active saturated compounds ASAHI DENKA KOGYO K.K. (JP) 1994-10-04 US disclosed
US-5262552-A Optically active compounds and intermediates thereof, and process for manufacturing same ASAHI DENKA KOGYO K.K. (JP) 1993-11-16 US disclosed
JP-H0449287-A OPTICALLY ACTIVE DELTA-LACTONE DERIVATIVE ASAHI DENKA KOGYO KK 1992-02-18 JP disclosed