SCHEMBL2960711

SCHEMBL2960711

CC1=C(c2ccc(C)cc2)c2c(Br)cccc2C1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
TP53 P04637 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PTGS2 P35354 1/20 0.31
GAA P10253 2/20 0.30
KDM4E B2RXH2 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
SCHEMBL2969356 0.88 FABP4 (0.36) MAPK1ALDH1A1
SCHEMBL2967198 0.79 RAPGEF4 (0.32) SMN1; SMN2HPGDKDM4EMEN1MAPT
SCHEMBL2971063 0.74 ALDH1A1 (0.34) L3MBTL1ALOX15HSD17B10MEN1MAPT
SCHEMBL2959111 0.74 ALDH1A1 (0.34) MEN1KMT2AALDH1A1
SCHEMBL1043440 0.73 ALDH1A1 (0.43) NPC1RAB9ASMN1; SMN2TP53NFKB1
SCHEMBL2969601 0.73 NPC1 (0.40) NPC1RAB9ASMN1; SMN2ESR1ESR2
SCHEMBL12213268 0.69 CYP3A4 (0.43) L3MBTL1ALOX15HSD17B10MEN1MAPT
SCHEMBL20248568 0.68 METAP1 (0.41) NPC1RAB9ASMN1; SMN2MAPK1HPGD
SCHEMBL18462293 0.67 NPC1 (0.46) NPC1RAB9ASMN1; SMN2TP53NFKB1
SCHEMBL2959837 0.67 ESR1 (0.48) NPC1RAB9ASMN1; SMN2ESR1ESR2

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 4083/4885RAB9A 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.