SCHEMBL2976114

SCHEMBL2976114

Cc1ccc(C2=CC(C)c3c(Br)cccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.38
TP53 P04637 2/20 0.38
MAPK1 P28482 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
USP2 O75604 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL2972664 0.86 MAPK1 (0.45) RAB9ASMN1; SMN2TP53MAPK1NFKB1
SCHEMBL2972588 0.80 MAOA (0.31)
SCHEMBL2974296 0.79 ALDH1A1 (0.35) ALDH1A1
SCHEMBL2972370 0.78 HSD11B1 (0.37) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL2971613 0.77 ALDH1A1 (0.33) MAPK1ALDH1A1
SCHEMBL2969182 0.74 PTPN1 (0.37) NPC1RAB9ASMN1; SMN2HPGDHSD17B10
SCHEMBL2966197 0.70 ALDH1A1 (0.39) NPC1RAB9ASMN1; SMN2MAPK1MEN1
SCHEMBL1042409 0.69 NPC1 (0.47) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL1047461 0.68 ALDH1A1 (0.65) NPC1RAB9ASMN1; SMN2TP53MAPK1
SCHEMBL18462293 0.67 NPC1 (0.46) NPC1RAB9ASMN1; SMN2TP53MAPK1

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 2 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

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 4083/4885RAB9A 1848/4885SMN1; SMN2 4156/4885

“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.