SCHEMBL2964722

SCHEMBL2964722

Cc1cc2ccc(Br)cc2cc1C1C=Cc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.40
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
DHODH Q02127 1/20 0.31
HTR2A P28223 4/20 0.30
HTR2C P28335 4/20 0.30
DRD2 P14416 2/20 0.30
ADRA2A P08913 1/20 0.30
ADRA2C P18825 1/20 0.30
DRD1 P21728 1/20 0.30
HTR7 P34969 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 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
SCHEMBL2963722 1.00 CYP2A6 (0.40) CYP2A6KDM4EMEN1ALDH1A1MAPT
SCHEMBL27640461 0.87 SIGMAR1 (0.33) CYP2A6HTR2A
SCHEMBL2964294 0.80 CYP2A6 (0.44) CYP2A6KDM4EMEN1ALDH1A1MAPT
SCHEMBL2960249 0.80 CYP2A6 (0.35) CYP2A6
SCHEMBL2969251 0.78 SIRT2 (0.36) CYP2A6
SCHEMBL2971420 0.78 CYP2A6 (0.43) CYP2A6KDM4EMEN1ALDH1A1MAPT
SCHEMBL2962076 0.78 SIGMAR1 (0.31) ALDH1A1HTR2A
SCHEMBL2964360 0.78 SIGMAR1 (0.31) ALDH1A1HTR2A
SCHEMBL2966546 0.78 CYP2A6 (0.33) CYP2A6
SCHEMBL2963349 0.78 CYP2A6 (0.40) CYP2A6

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 CYP2A6 2465/4885KDM4E 2177/4885MEN1 750/4885

“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.