SCHEMBL2969182

SCHEMBL2969182

CC1C=C(c2cccc3ccccc23)c2cccc(Br)c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.37
KDM4E B2RXH2 2/20 0.34
ALPL P05186 1/20 0.34
GAA P10253 1/20 0.34
SLC6A3 Q01959 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ALDH1A1 P00352 2/20 0.32
CYP2A6 P11509 1/20 0.32
ALOX15 P16050 2/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
DHFR P00374 1/20 0.32
FNTA P49354 1/20 0.32

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 0.80 MAPK1 (0.45) PTPN1ALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL2975774 0.79 PTPN1 (0.36) PTPN1KDM4EALPLGAASLC6A3
SCHEMBL2974296 0.76 ALDH1A1 (0.35) ALDH1A1MAOAMAOB
SCHEMBL2970966 0.76 CYP1A2 (0.39) PTPN1KDM4EALPLGAASLC6A3
SCHEMBL2976114 0.74 NPC1 (0.40) KDM4EGAAALDH1A1NPC1MAPT
SCHEMBL2972588 0.71 MAOA (0.31) MAOAMAOB
SCHEMBL2971613 0.71 ALDH1A1 (0.33) ALDH1A1MAOAMAOB
SCHEMBL29634644 0.69 ALDH1A1 (0.46) PTPN1KDM4EALPLGAACA12
SCHEMBL365314 0.69 ALDH1A1 (0.46) PTPN1KDM4EALPLGAACA12
Hydrochloric Acid SCHEMBL8058620 0.69 PTPN1 (0.37) PTPN1KDM4EALPLGAASLC6A3

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 PTPN1 4091/4885KDM4E 2177/4885ALPL 3270/4885

“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.