SCHEMBL17961006

SCHEMBL17961006

O=C(O)c1ccc(Oc2ccc(Oc3ccc4c(c3)C(=O)OC4=O)cc2)cc1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.57
▸ CA2 P00918 2/20 0.49
▸ HPSE Q9Y251 1/20 0.47
▸ MAOA P21397 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ TDP1 Q9NUW8 4/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TYMS P04818 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ PYGL P06737 2/20 0.44
▸ PYGM P11217 2/20 0.44
▸ CA12 O43570 5/20 0.44
▸ CA7 P43166 5/20 0.44
▸ CA1 P00915 4/20 0.44
▸ CA4 P22748 2/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ GALK1 P51570 1/20 0.42
▸ CASP6 P55212 1/20 0.42

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
SCHEMBL29126596 0.98 POLB (0.55) POLBCA2HPSEMAOAMAOB
SCHEMBL10514322 0.91 POLB (0.51) POLBCA2HPSETDP1LMNA
SCHEMBL24790646 0.90 POLB (0.47) POLBCA2HPSEMAOAMAOB
SCHEMBL19427482 0.90 POLB (0.48) POLBCA2HPSEMAOAMAOB
SCHEMBL4449454 0.85 CA2 (0.43) POLBCA2HPSEMAOAMAOB
SCHEMBL9008360 0.84 SRD5A2 (0.53) POLBCA2MAOAMAOBCA12
SCHEMBL31065558 0.84 SRD5A2 (0.53) POLBCA2MAOAMAOBCA12
SCHEMBL11051059 0.84 TYMS (0.52) POLBCA2HPSETDP1LMNA
SCHEMBL1501398 0.83 MAOA (0.56) POLBMAOAMAOBTDP1LMNA
SCHEMBL30970619 0.83 MAOA (0.56) POLBMAOAMAOBTDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10431858-B2 Systems, structures and materials for electrochemical device thermal management LATENT HEAT SOLUTIONS, LLC 2019-10-01 — — US disclosed
US-20160226114-A1 SYSTEMS, STRUCTURES AND MATERIALS FOR ELECTROCHEMICAL DEVICE THERMAL MANAGEMENT LATENT HEAT SOLUTIONS, LLC 2016-08-04 — — US disclosed
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