SCHEMBL15095433

SCHEMBL15095433

O=C1C[C@@H](COCc2ccccc2)C(=O)O1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
AKT1 P31749 1/20 0.44
TSHR P16473 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
PTPN1 P18031 2/20 0.39
CDC25B P30305 1/20 0.39
ACHE P22303 4/20 0.39
BCHE P06276 2/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
BUB1 O43683 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL15095406 1.00 LMNA (0.48) LMNAAKT1TSHRTAAR1PTPN1
SCHEMBL12000456 0.79 ALDH1A1 (0.41) TSHR
SCHEMBL9740200 0.78 MAOB (0.45) TSHRPOLBHTTMAPT
SCHEMBL638641 0.78 MAOB (0.45) TSHRPOLBHTTMAPT
SCHEMBL5725152 0.78 TAAR1 (0.50) LMNATSHRTAAR1CYP3A4MAPT
SCHEMBL3142790 0.76 LMNA (0.63) LMNAAKT1TSHRTAAR1PTPN1
SCHEMBL60686 0.76 FASN (0.45) TAAR1CYP3A4MAPT
SCHEMBL30226689 0.75 LMNA (0.48) LMNATSHRTAAR1ACHE
SCHEMBL28660105 0.74 PSEN1 (0.41) LMNAAKT1TSHRMAPTCYP2C19
SCHEMBL1930872 0.74 PSEN1 (0.41) LMNAAKT1TSHRMAPTCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376413-B1 Succinic anhydrides from epoxides CORNELL UNIVERSITY (US) 2016-06-28 US disclosed
US-9376413-B1 Succinic anhydrides from epoxides CORNELL UNIVERSITY (US) 2016-06-28 US disclosed
US-8921581-B1 Succinic anhydrides from epoxides CORNELL RESEARCH FOUNDATION, INC. (US) 2014-12-30 US disclosed
US-8921581-B1 Succinic anhydrides from epoxides CORNELL RESEARCH FOUNDATION, INC. (US) 2014-12-30 US disclosed
US-8481756-B1 Succinic anhydrides from epoxides CORNELL RESEARCH FOUNDATION, INC. (US) 2013-07-09 US disclosed
US-8481756-B1 Succinic anhydrides from epoxides CORNELL RESEARCH FOUNDATION, INC. (US) 2013-07-09 US disclosed