Sugi Predict

Sugi Predict / Compounds / SCHEMBL9284056

SCHEMBL9284056

SCHEMBL9284056

COCCCCCN(C(=S)c1c(O)c2cc(Cl)ccc2n(C)c1=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 6/20 0.46
▸ MEN1 O00255 4/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ HIF1A Q16665 6/20 0.39
▸ PGR P06401 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ EGFR P00533 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36

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
SCHEMBL9268854 0.81 HIF1A (0.48) MEN1KMT2AHIF1APGRALDH1A1
SCHEMBL8085817 0.79 MEN1 (0.56) GSK3BMEN1KMT2AHIF1APGR
SCHEMBL9270246 0.76 MEN1 (0.47) GSK3BMEN1KMT2AHIF1APGR
SCHEMBL9269052 0.76 HIF1A (0.43) MEN1KMT2AHIF1AALDH1A1
SCHEMBL9282960 0.75 GSK3B (0.43) GSK3BMEN1KMT2AHIF1APGR
SCHEMBL9267786 0.74 GSK3B (0.41) GSK3BHIF1AALDH1A1
SCHEMBL9269029 0.74 MEN1 (0.46) GSK3BMEN1KMT2AHIF1APGR
SCHEMBL8086963 0.71 GSK3B (0.43) GSK3BMEN1KMT2AHIF1APGR
SCHEMBL10674315 0.71 MEN1 (0.74) GSK3BMEN1KMT2AHIF1APGR
SCHEMBL9279359 0.70 MEN1 (0.56) GSK3BMEN1KMT2AHIF1APGR

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-1995024395-A1 QUINOLINE DERIVATIVES AS IMMUNOMODULATORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-09-14 — — WO disclosed
Send feedback