SCHEMBL9881386

SCHEMBL9881386

CC1C(C(=O)N2CCN(C)CC2)[C@@H]2C=C[C@H]1O2

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPP5C P53041 2/20 0.49
▸ TFPI2 P48307 2/20 0.49
▸ PPP2CA P67775 1/20 0.49
▸ NPY4R P50391 1/20 0.49
▸ HTT P42858 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ TSHR P16473 1/20 0.39
▸ CYP1A2 P05177 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ HSD11B1 P28845 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HPGD P15428 1/20 0.33

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
SCHEMBL9880146 0.84 TFPI2 (0.60) PPP5CTFPI2PPP2CANPY4RHTT
SCHEMBL13001974 0.83 CHRNB2 (0.43) PPP5CTFPI2PPP2CANPY4RHSD11B1
SCHEMBL9880162 0.83 PPP5C (0.48) PPP5CTFPI2PPP2CANPY4RHTT
SCHEMBL9880160 0.80 TSHR (0.54) PPP5CTFPI2PPP2CANPY4RHTT
SCHEMBL12123980 0.80 TFPI2 (0.46) PPP5CTFPI2PPP2CANPY4RHTT
SCHEMBL16731268 0.75 PPP5C (0.41) PPP5CTFPI2PPP2CANPY4RHTT
SCHEMBL9880171 0.73 PPP5C (0.39) PPP5CTFPI2PPP2CANPY4RHTT
SCHEMBL9881182 0.72 TFPI2 (0.71) PPP5CTFPI2PPP2CANPY4RHTT
SCHEMBL16731415 0.71 PPARG (0.39) PPP5CTFPI2PPP2CANPY4RHTT
SCHEMBL3294090 0.69 PPM1B (0.52) PPP5CTSHRCYP1A2TDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329719-B2 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. (US) 2012-12-11 — — US disclosed
US-20120135522-A1 METHODS OF MODULATING CELL REGULATION BY INHIBITING P53 LIXTE BIOTECHNOLOGY, INC. 2012-05-31 — — US disclosed
US-20110287537-A1 NEUROPROTECTIVE AGENTS FOR THE PREVENTION AND TREATMENT OF NEURODEGENERATIVE DISEASES LIXTE BIOTECHNOLOGY, INC. 2011-11-24 — — US disclosed
US-8058268-B2 Neuroprotective agents for the prevention and treatment of neurodegenerative diseases LIXTE BIOTECHNOLOGY, INC. (US) 2011-11-15 — — US disclosed
Send feedback