SCHEMBL11262309

SCHEMBL11262309

CC1C(C(=O)O)C(C(=O)O)C2C(=O)OC(=O)C12

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ CTDSP1 Q9GZU7 1/20 0.33
▸ EDNRB P24530 1/20 0.32
▸ EDNRA P25101 1/20 0.32
▸ GRM2 Q14416 1/20 0.31
▸ GRM3 Q14832 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ GMNN O75496 1/20 0.31
▸ PPM1B O75688 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ PPP1CC P36873 1/20 0.31
▸ TFPI2 P48307 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ PPP5C P53041 1/20 0.31
▸ PPP1CA P62136 1/20 0.31
▸ PMP22 Q01453 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP2D6 P10635 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
SCHEMBL3137226 0.87 EDNRB (0.39) TDP1POLBCTDSP1EDNRBEDNRA
SCHEMBL9994809 0.84 EDNRB (0.38) TDP1EDNRBEDNRAGRM2GRM3
SCHEMBL1436171 0.84 EDNRB (0.38) TDP1EDNRBEDNRAGRM2GRM3
SCHEMBL8918724 0.82 KDM4E (0.39) TDP1POLBCTDSP1EDNRBEDNRA
SCHEMBL31509894 0.82 KDM4E (0.39) TDP1POLBCTDSP1EDNRBEDNRA
SCHEMBL15247103 0.71 KDM4E (0.42) TDP1KDM4EGMNNPPM1BLMNA
SCHEMBL2699713 0.71 KDM4E (0.42) TDP1KDM4EGMNNPPM1BLMNA
SCHEMBL12834033 0.69 KDM4E (0.30) TDP1KDM4EGMNNPPM1BLMNA
SCHEMBL24489924 0.69 KDM4E (0.36) TDP1KDM4EGMNNPPM1BLMNA
SCHEMBL9306839 0.68 PPP5C (0.36) TDP1POLBGRM2GRM3KDM4E

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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