SCHEMBL27896459

SCHEMBL27896459

CCCCCOC=O.O=C1CCN(c2ncccc2Cl)N1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 7/20 0.40
▸ GLP1R P43220 1/20 0.35
▸ CDC25B P30305 1/20 0.34
▸ G6PD P11413 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ S1PR5 Q9H228 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 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
SCHEMBL28178496 0.81 ALOX5 (0.58) ALOX5GLP1RG6PDALOX15ALOX12
SCHEMBL29386746 0.81 ALOX5 (0.58) ALOX5GLP1RG6PDALOX15ALOX12
SCHEMBL28799494 0.79 CDC25B (0.33) CDC25BS1PR5NPC1RAB9A
Propionic Acid SCHEMBL29128109 0.78 ALOX5 (0.47) ALOX5GLP1RG6PDALOX15ALOX12
SCHEMBL28589887 0.76 ALOX5 (0.52) ALOX5GLP1RG6PDALOX15ALOX12
SCHEMBL28799493 0.69 HSD11B1 (0.30) —
SCHEMBL27640770 0.68 HSD11B1 (0.31) —
SCHEMBL591711 0.67 KDM4E (0.40) S1PR5
SCHEMBL13412670 0.66 ALOX5 (0.56) ALOX5G6PDALOX15ALOX12PTGS1
SCHEMBL31054347 0.65 HSD11B1 (0.38) ALOX5

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
CN-101945861-B Preparation method of phenylcarboxamides SINOCHEM CORP 2012-11-21 — — CN disclosed
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