SCHEMBL21500751

SCHEMBL21500751

Oc1c2c(cc3c1CCCO3)OCCC2

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ NLRP3 Q96P20 1/20 0.32
▸ CTNNB1 P35222 2/20 0.32
▸ WNT3A P56704 2/20 0.32
▸ HTR1A P08908 1/20 0.31
▸ HTR1D P28221 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ HTR2C P28335 1/20 0.31
▸ HTR2B P41595 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30

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
SCHEMBL3190996 0.77 MAOA (0.37) SMN1; SMN2MAOAMAOBNPC1RAB9A
SCHEMBL30392289 0.77 MAOA (0.37) SMN1; SMN2MAOAMAOBNPC1RAB9A
SCHEMBL21500712 0.75 ALOX5 (0.31) HTR2AHTR2CHTR2BALOX5NPC1
SCHEMBL6623175 0.75 HTR2C (0.38) MAOAMAOBCTNNB1WNT3AHTR1A
SCHEMBL10033616 0.74 FFAR4 (0.37) SMN1; SMN2MAOAMAOBCTNNB1WNT3A
SCHEMBL14390906 0.74 ALOX15 (0.38) SMN1; SMN2ALOX5NPC1RAB9A
SCHEMBL23259145 0.71 DBH (0.38) MAOAMAOBHTR1AHTR1DHTR2A
SCHEMBL26042290 0.71 MAOA (0.37) SMN1; SMN2MAOAMAOBCTNNB1WNT3A
SCHEMBL15628793 0.71 ALDH1A1 (0.32) PRKCIMAOAMAOB
SCHEMBL26159938 0.71 TDP1 (0.34) SMN1; SMN2MAOAMAOBNPC1RAB9A

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
WO-2019202140-A1 PROCESS FOR DYEING KERATIN FIBRES COMPRISING THE APPLICATION OF A CHROMENOL/CHROMEN-2-ONE DERIVATIVE, COMPOSITION AND DEVICE L'OREAL (FR) 2019-10-24 — — WO disclosed
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