SCHEMBL19867625

SCHEMBL19867625

CCN(CC)c1ccc(N=Nc2ccc(OC(=O)C(CC(C)C)C(C)C)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.41
▸ MAPT P10636 9/20 0.39
▸ KMT2A Q03164 7/20 0.39
▸ NPC1 O15118 6/20 0.39
▸ RAB9A P51151 6/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ TDP1 Q9NUW8 4/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ ELANE P08246 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ POLB P06746 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ CNR2 P34972 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPK1 P28482 4/20 0.36
▸ HTT P42858 1/20 0.36
▸ NOX1 Q9Y5S8 1/20 0.34

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
SCHEMBL19215817 0.84 ELANE (0.42) MAPTKMT2ANPC1RAB9ATDP1
SCHEMBL17131756 0.83 GSK3B (0.43) GSK3BMAPTKMT2ANPC1RAB9A
SCHEMBL19215818 0.80 PPARD (0.42) MAPTELANEALDH1A1
SCHEMBL19930175 0.78 GSK3B (0.47) GSK3BMAPTKMT2ANPC1RAB9A
SCHEMBL18254165 0.76 PRSS1 (0.49) GSK3BMAPTKMT2ANPC1RAB9A
SCHEMBL25522011 0.75 LMNA (0.47) KMT2AMEN1LMNAELANEALDH1A1
SCHEMBL21291493 0.75 ELANE (0.42) MAPTSMN1; SMN2LMNAELANEGAA
SCHEMBL19573301 0.73 ATM (0.50) MAPTKMT2ANPC1RAB9AMEN1
SCHEMBL17131755 0.73 KMT2A (0.51) GSK3BMAPTKMT2ANPC1RAB9A
SCHEMBL18821734 0.72 RAB9A (0.64) MAPTKMT2ANPC1RAB9AMEN1

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-20180045870-A1 TRANSPARENT FILM, POLARIZING PLATE, AND IMAGE DISPLAYING DEVICE FUJIFILM CORPORATION (JP) 2018-02-15 — — US disclosed
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