SCHEMBL2971504

SCHEMBL2971504

CCCCCCCC1=Cc2cccc(Br)c2C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.38
GPR84 Q9NQS5 1/20 0.33
TRPA1 O75762 1/20 0.33
RECQL P46063 1/20 0.33
LIPG Q9Y5X9 2/20 0.32
LPL P06858 1/20 0.32
SLC6A2 P23975 3/20 0.32
SLC6A4 P31645 3/20 0.32
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
DRD2 P14416 1/20 0.32
PTPN1 P18031 1/20 0.31
ESR1 P03372 2/20 0.31
ADRA2A P08913 2/20 0.31
ADORA3 P0DMS8 2/20 0.31
TACR2 P21452 2/20 0.31
SLC6A3 Q01959 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL2956645 1.00 KCNH2 (0.38) KCNH2GPR84TRPA1RECQLLIPG
SCHEMBL2962064 1.00 KCNH2 (0.38) KCNH2GPR84TRPA1RECQLLIPG
SCHEMBL2972342 1.00 KCNH2 (0.38) KCNH2GPR84TRPA1RECQLLIPG
SCHEMBL2965795 1.00 KCNH2 (0.38) KCNH2GPR84TRPA1RECQLLIPG
SCHEMBL2972173 0.98 KCNH2 (0.35) KCNH2GPR84TRPA1RECQLLIPG
SCHEMBL2967040 0.94 TRPA1 (0.35) TRPA1
SCHEMBL2967415 0.87 TRPA1 (0.36) TRPA1ALDH1A1
SCHEMBL2971532 0.80 TRPA1 (0.38) TRPA1
SCHEMBL2969328 0.76 HTR2A (0.39) KCNH2GPR84RECQLLIPGLPL
SCHEMBL2957327 0.76 HTR2A (0.39) KCNH2GPR84RECQLLIPGLPL

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 KCNH2 3320/4885GPR84 3428/4885TRPA1 438/4885

“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.