SCHEMBL31322320

SCHEMBL31322320

N=c1ccc2cc3ccccc3oc-2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.57
MAOB P27338 4/20 0.56
MAOA P21397 2/20 0.53
PTPRC P08575 1/20 0.51
PTPN1 P18031 1/20 0.51
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
RAB9A P51151 6/20 0.45
NPC1 O15118 4/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NFKB1 P19838 1/20 0.45
NPY1R P25929 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
METAP2 P50579 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
SCHEMBL14137597 1.00 ALOX5 (0.57) ALOX5MAOBMAOAPTPRCPTPN1
Iodide SCHEMBL28186973 0.96 ALOX5 (0.54) ALOX5MAOBMAOAPTPRCPTPN1
SCHEMBL6583412 0.81 ALOX5 (0.66) ALOX5MAOBMAOAPTPRCPTPN1
SCHEMBL4659168 0.78 MAOB (0.78) ALOX5MAOBMAOAPTPRCPTPN1
SCHEMBL223274 0.78 PTPRC (0.59) ALOX5MAOBMAOAPTPRCPTPN1
SCHEMBL29791652 0.78 PTPRC (0.59) ALOX5MAOBMAOAPTPRCPTPN1
SCHEMBL308355 0.77 CA2 (0.42) ALOX5CA2RAB9ANPC1ALDH1A1
SCHEMBL28348664 0.76 PTPRC (0.58) ALOX5MAOBMAOAPTPRCPTPN1
SCHEMBL14573098 0.76 ALOX5 (0.60) ALOX5MAOBMAOAPTPRCPTPN1
SCHEMBL4111056 0.76 MAOB (0.65) ALOX5MAOBMAOAPTPRCPTPN1

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-20250019555-A1 INK COMPOSITION FOR SURFACE PRINTING ON COSMETICS, AND METHOD FOR SURFACE PRINTING ON COSMETICS BY USING SAME ACTIVON CO., LTD. (KR) 2025-01-16 US disclosed