SCHEMBL2961427

SCHEMBL2961427

Cc1cc(Br)cc2c1C=CC2c1cccc2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.36
ALDH1A1 P00352 2/20 0.36
TRPM2 O94759 1/20 0.34
CYP1A2 P05177 3/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM1A O60341 1/20 0.33
SLC6A4 P31645 5/20 0.32
NQO2 P16083 1/20 0.32
SLC6A2 P23975 2/20 0.31
SLC6A3 Q01959 2/20 0.31
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
ALOX12 P18054 1/20 0.31
MTNR1A P48039 1/20 0.30
MTNR1B P49286 1/20 0.30
DRD2 P14416 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
SCHEMBL2971229 0.84 NQO2 (0.33) ALDH1A1NQO2MAPT
SCHEMBL2959115 0.81 HTR2C (0.34)
SCHEMBL2959653 0.81 EGFR (0.33) CYP2A6ALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL2962745 0.80 CYP2A6 (0.38) CYP2A6ALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL2974786 0.80 TRPM2 (0.35) CYP2A6ALDH1A1TRPM2CYP1A2HPGD
SCHEMBL2970573 0.78 NQO2 (0.33) NQO2
SCHEMBL2975187 0.78 CYP2A6 (0.36) CYP2A6KDM1ASLC6A4NQO2SLC6A2
SCHEMBL2971813 0.77 KDM1A (0.35) CYP2A6ALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL2960750 0.76 KDM1A (0.39) CYP2A6ALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL2970913 0.75 KDM1A (0.36) CYP2A6ALDH1A1CYP1A2HPGDKDM1A

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 2465/4885ALDH1A1 4332/4885TRPM2 383/4885

“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.