SCHEMBL2957246

SCHEMBL2957246

CCCCc1ccc(C2=C(C)Cc3ccc(Br)cc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
NFKB1 P19838 2/20 0.41
RAB9A P51151 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GAA P10253 1/20 0.40
SKP2 Q13309 1/20 0.37
HSD11B1 P28845 1/20 0.36
MPL P40238 2/20 0.35
EIF4A1 P60842 2/20 0.35
RARB P10826 2/20 0.35
NISCH Q9Y2I1 1/20 0.35
CHEK2 O96017 1/20 0.34
ROS1 P08922 1/20 0.34
MARK3 P27448 1/20 0.34
LTK P29376 1/20 0.34
FLT4 P35916 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
SCHEMBL2974440 0.92 NPC1 (0.42) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL2974708 0.80 ESR1 (0.44) NPC1RAB9ASMN1; SMN2L3MBTL1GAA
SCHEMBL2957244 0.78 TDP1 (0.35) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL16913152 0.77 ESR1 (0.43) SMN1; SMN2L3MBTL1GAACHEK2ROS1
SCHEMBL2970474 0.77 TDP1 (0.39) NPC1RAB9AMAPK1L3MBTL1CHEK2
SCHEMBL2971540 0.74 HSD11B1 (0.39) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL2960603 0.74 HSD11B1 (0.39) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL5008900 0.73 SLC6A2 (0.45) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL28895060 0.73 NPC1 (0.49) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL17616719 0.72 SCN1A (0.39) NPC1NFKB1RAB9ANFKB2RELA

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-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 US disclosed
WO-2006065809-A2 HETEROATOM BRIDGED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-22 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-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 NPC1 4083/4885NFKB1 1786/4885RAB9A 1848/4885

“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.