SCHEMBL11278993

SCHEMBL11278993

O=C(O)C1CC(C(=O)O)C2C(=O)OC(=O)C12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPM1B O75688 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ PMP22 Q01453 2/20 0.39
▸ GMNN O75496 1/20 0.39
▸ PPP1CC P36873 1/20 0.39
▸ TFPI2 P48307 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ PPP5C P53041 1/20 0.39
▸ PPP1CA P62136 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ THPO P40225 1/20 0.39
▸ GABRR1 P24046 5/20 0.39
▸ GRM2 Q14416 2/20 0.33
▸ GABRR2 P28476 1/20 0.33
▸ POLB P06746 1/20 0.32

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
SCHEMBL14675352 0.85 LMNA (0.35) PPM1BKDM4ELMNAPMP22GMNN
SCHEMBL3132343 0.77 GABRR1 (0.36) GABRR1GABRR2POLBTSHRKMO
SCHEMBL168963 0.76 GABRR1 (0.39) KDM4ELMNAPMP22GABRR1GRM2
SCHEMBL3405524 0.76 LMNA (0.35) PPM1BKDM4ELMNAPMP22GMNN
SCHEMBL3782943 0.76 KDM4E (0.32) PPM1BKDM4ELMNAPMP22GMNN
SCHEMBL12974965 0.74 KDM4E (0.43) PPM1BKDM4ELMNAPMP22GMNN
SCHEMBL28252757 0.74 PPM1B (0.47) PPM1BKDM4ELMNAPMP22GMNN
SCHEMBL1537491 0.74 LMNA (0.35) PPM1BKDM4ELMNAPMP22GMNN
SCHEMBL6739899 0.73 SLC1A2 (0.37) PPM1BKDM4ELMNAPMP22GMNN
SCHEMBL6321820 0.73 TDP1 (0.40) PPM1BKDM4ELMNAPMP22GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4366302-A HEAT RESISTANCE CURING AGENTS LORD CORPORATION (US) 1982-12-28 — — US disclosed
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