SCHEMBL2970237

SCHEMBL2970237

CC1=Cc2cc(Br)ccc2C1c1ccc2ccccc2c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.44
KDM1A O60341 2/20 0.37
RCOR1 Q9UKL0 2/20 0.37
DHODH Q02127 1/20 0.34
EGFR P00533 2/20 0.34
ERBB2 P04626 2/20 0.34
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A3 Q01959 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL2963351 0.89 CYP2A6 (0.44) CYP2A6KDM1ARCOR1DHODHEGFR
SCHEMBL6662143 0.83 CYP2A6 (0.38) CYP2A6EGFRERBB2HTR2CHTR2B
SCHEMBL2971669 0.83 HDAC4 (0.36) KDM1AHTR2CSLC6A4SLC6A2KDM4E
SCHEMBL2974710 0.81 ALDH1A1 (0.44) KDM1AHTR2CHTR2BSLC6A4SLC6A2
SCHEMBL2971361 0.80 ALDH1A1 (0.39) KDM1ASLC6A4SLC6A2SLC6A3KDM4E
SCHEMBL2962848 0.78 KDM1A (0.38) CYP2A6KDM1AEGFRERBB2HTR2C
SCHEMBL2963229 0.77 KDM4E (0.36) CYP2A6KDM1ARCOR1HTR2CHTR2B
SCHEMBL2963726 0.77 KDM4E (0.36) CYP2A6KDM1ARCOR1EGFRERBB2
SCHEMBL2975457 0.76 MAPK1 (0.35) HTR2CHTR2BSLC6A4SLC6A2LMNA
SCHEMBL12546461 0.75 CYP2A6 (0.53) CYP2A6KDM1ARCOR1EGFRERBB2

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 2465/4885KDM1A 3280/4885RCOR1 2210/4885

“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.