SCHEMBL9765547

SCHEMBL9765547

O=C(O)CCC(NC(=O)[C@@H]1CC[C@H](Oc2ccc(C(=O)c3ccccc3)c(Cl)c2Cl)C1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.37
▸ PKLR P30613 1/20 0.36
▸ FOLH1 Q04609 2/20 0.36
▸ NAALAD2 Q9Y3Q0 3/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ PLG P00747 1/20 0.34
▸ RORC P51449 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33
▸ PYGL P06737 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
SCHEMBL9765587 1.00 POLB (0.40) POLBGAAPKLRFOLH1NAALAD2
SCHEMBL195323 1.00 POLB (0.40) POLBGAAPKLRFOLH1NAALAD2
SCHEMBL9765550 1.00 POLB (0.40) POLBGAAPKLRFOLH1NAALAD2
SCHEMBL9765570 1.00 POLB (0.40) POLBGAAPKLRFOLH1NAALAD2
SCHEMBL9765574 1.00 POLB (0.40) POLBGAAPKLRFOLH1NAALAD2
SCHEMBL9765586 0.93 KMT2A (0.39) POLBLMNATDP1PLGPYGL
SCHEMBL9765595 0.93 KMT2A (0.39) POLBLMNATDP1PLGPYGL
SCHEMBL9799885 0.91 PYGL (0.35) GAAPKLRLMNATDP1PLG
SCHEMBL9765599 0.90 LMNA (0.36) LMNATDP1PLGRORC
SCHEMBL9765596 0.90 LMNA (0.36) LMNATDP1PLGRORC

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-5023268-A Therapy for cerebral edema ONO PHARMACEUTICAL CO., LTD. (JP) 1991-06-11 — — US disclosed
US-4888351-A TREATMENT OF CEREBRAL EDEMA ONO PHARMACEUTICAL CO., LTD. (JP) 1989-12-19 — — US disclosed
US-4829078-A CEREBRAL EDEMA ONO PHARMACEUTICAL CO., LTD. (JP) 1989-05-09 — — US disclosed
US-4783476-A 3-Phenoxy (or phenylthio)-cyclopentanecarbonylamino acid analogues ONO PHARMACEUTICAL CO., LTD. (JP) 1988-11-08 — — US disclosed
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