SCHEMBL8391687

SCHEMBL8391687

O=C(Nc1ccc(O)cc1)NC1CCCCCCCCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 14/20 1.00
RAB9A P51151 10/20 0.73
NPC1 O15118 8/20 0.73
EPHX2 P34913 5/20 0.73
SMN1; SMN2 Q16637 3/20 0.73
ALDH1A1 P00352 1/20 0.73
CYP2C9 P11712 1/20 0.73
CYP2C19 P33261 1/20 0.73
MEN1 O00255 1/20 0.73
KMT2A Q03164 1/20 0.73
GAA P10253 1/20 0.73
TP53 P04637 1/20 0.68
NFKB1 P19838 1/20 0.68
NFKB2 Q00653 1/20 0.68
RELA Q04206 1/20 0.68

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
SCHEMBL12196184 1.00 EPHX1 (1.00) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL13756244 0.93 EPHX1 (0.86) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL27980408 0.91 EPHX1 (0.83) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL13756248 0.91 EPHX1 (0.83) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL24988039 0.85 EPHX1 (0.73) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL813709 0.85 EPHX1 (1.00) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL3865925 0.85 EPHX1 (1.00) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL10089307 0.85 EPHX1 (1.00) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL12196168 0.85 RAB9A (1.00) EPHX1RAB9ANPC1EPHX2SMN1; SMN2
SCHEMBL4319424 0.85 EPHX1 (1.00) EPHX1RAB9ANPC1EPHX2SMN1; SMN2

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-6004899-A SURFACE TREATED WITH SILANE, TITANATE, AND/OR ALUMINUM COUPLING AGENT; PIGMENT; ERASIBILITY MITSUBISHI PAPER MILLS LIMITED (JP) 1999-12-21 US disclosed