SCHEMBL7787321

SCHEMBL7787321

CC=C1CCCCC1CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
TP53 P04637 1/20 0.37
FFAR1 O14842 1/20 0.33
KDM4E B2RXH2 2/20 0.33
AKR1C4 P17516 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
TBXA2R P21731 5/20 0.32
PTGDR Q13258 5/20 0.32
PDE2A O00408 1/20 0.32
POLB P06746 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
ACE P12821 1/20 0.31
PPARD Q03181 1/20 0.31

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
SCHEMBL9445803 0.77 TP53 (0.32) L3MBTL1TP53TBXA2RPTGDRPDE2A
SCHEMBL761888 0.74 ITGB1 (0.35) L3MBTL1TP53AKR1C4AKR1C3AKR1C2
SCHEMBL2764882 0.73 KDM4E (0.50) L3MBTL1TP53KDM4EALDH1A1MAPT
SCHEMBL10516182 0.72 KDM4E (0.38) L3MBTL1KDM4EPOLBTSHR
SCHEMBL11086697 0.72 KDM4E (0.49) L3MBTL1TP53KDM4EALDH1A1MAPT
SCHEMBL10505153 0.72 KDM4E (0.49) L3MBTL1TP53KDM4EALDH1A1MAPT
SCHEMBL11089825 0.72 KDM4E (0.49) L3MBTL1TP53KDM4EALDH1A1MAPT
SCHEMBL3602796 0.72 KDM4E (0.49) L3MBTL1TP53KDM4EALDH1A1MAPT
SCHEMBL22204598 0.72 L3MBTL1 (0.40) L3MBTL1TP53FFAR1KDM4ETBXA2R
SCHEMBL8433568 0.72 KDM4E (0.49) L3MBTL1TP53KDM4ETBXA2RPTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0745071-B1 4-AMINO 6-SUBSTITUTED MYCOPHENOLIC ACID AND DERIVATIVES WITH IMMUNOSUPPRESSIVE ACTIVITY SYNTEX LLC (US) 2001-12-05 EP disclosed
EP-0745072-B1 4-AMINO DERIVATIVES OF 5-SUBSTITUTED MYCOPHENOLIC ACID SYNTEX INC (US) 1998-05-06 EP disclosed
EP-0745071-A1 4-AMINO 6-SUBSTITUTED MYCOPHENOLIC ACID AND DERIVATIVES WITH IMMUNOSUPPRESSIVE ACTIVITY SYNTEX (U.S.A.) INC. (US) 1996-12-04 EP disclosed
EP-0745072-A1 4-AMINO DERIVATIVES OF 5-SUBSTITUTED MYCOPHENOLIC ACID SYNTEX (U.S.A.) INC. (US) 1996-12-04 EP disclosed
US-5554612-A IMMUNOSUPPRESSANTS, VIRICIDES, ANTITUMOR AND ANTIINFLAMMATORY AGENTS SYNTEX INC (US) 1996-09-10 US disclosed
US-5538969-A IMMUNOSUPPRESSANTS SYNTEX (U.S.A.) INC. (US) 1996-07-23 US disclosed
US-5525602-A TREATING INFLAMMATORY DISEASES, PREVENTING ALLOGRAFT REJECTION, AUTOIMMUNE DISEASES SYNTEX (U.S.A.) INC. (US) 1996-06-11 US disclosed
US-5512568-A FOR TREATING A MAMMAL HAVING A DISEASE STATE THAT IS ALLEVIATED BY TREATMENT WITH AN INOSINE 5'-MONOPHOSPHATE DEHYDROGENASE INHIBITOR SYNTEX (U.S.A.) INC. (US) 1996-04-30 US disclosed
WO-1995022534-A1 4-AMINO 6-SUBSTITUTED MYCOPHENOLIC ACID AND DERIVATIVES WITH IMMUNOSUPPRESSIVE ACTIVITY SYNTEX (U.S.A.) INC. (US) 1995-08-24 WO disclosed
WO-1995022537-A2 4-AMINO DERIVATIVES OF 5-SUBSTITUTED MYCOPHENOLIC ACID SYNTEX (U.S.A.) INC. (US) 1995-08-24 WO disclosed