SCHEMBL3662316

SCHEMBL3662316

COc1cc(F)ccc1C(=Cc1ccccc1Cl)CCl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 3/20 0.44
AR P10275 1/20 0.39
NFE2L2 Q16236 5/20 0.38
NR3C1 P04150 2/20 0.37
NR3C2 P08235 2/20 0.37
KCNH2 Q12809 1/20 0.37
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 1/20 0.36
PLIN1 O60240 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
PLIN5 Q00G26 1/20 0.36
KMT2A Q03164 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
SCHEMBL3662315 1.00 ABCG2 (0.44) ABCG2ARNFE2L2NR3C1NR3C2
SCHEMBL3664086 0.89 NFE2L2 (0.46) ARNFE2L2MAPTNPC1RELA
SCHEMBL3772509 0.89 NFE2L2 (0.46) ARNFE2L2MAPTNPC1RELA
SCHEMBL3821269 0.88 AR (0.39) ABCG2ARNFE2L2NR3C1MAPT
SCHEMBL3659247 0.88 AR (0.39) ABCG2ARNFE2L2NR3C1MAPT
SCHEMBL3764145 0.84 NPC1 (0.39) ABCG2MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL3662523 0.84 NPC1 (0.39) ABCG2MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL3776287 0.83 NFE2L2 (0.38) NFE2L2NR3C2MAPTNPC1RAB9A
SCHEMBL3662395 0.83 NFE2L2 (0.38) NFE2L2NR3C2MAPTNPC1RAB9A
SCHEMBL3762718 0.80 MDM2 (0.40) ARNFE2L2MAPTNPC1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same BASF SE (DE) 2010-12-16 US disclosed
EP-2234488-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2010-10-06 EP disclosed
WO-2009077443-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2009-06-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same XDH, NOX5, TET1 ABCG2 2920/4885AR 3658/4885NFE2L2 825/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.