SCHEMBL2960601

SCHEMBL2960601

CCCCc1ccccc1C1=C(C)Cc2cccc(Br)c21

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.32
CTSG P08311 1/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
LIPG Q9Y5X9 1/20 0.31
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
PNMT P11086 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
SCHEMBL2971538 0.82 BCHE (0.33) ELANECTSGNR1H2NR1H3LIPG
SCHEMBL2957244 0.77 TDP1 (0.35) NR1H2NR1H3LIPG
SCHEMBL2974436 0.77 HSD17B3 (0.35) NR1H2NR1H3PNMT
SCHEMBL2963223 0.74 DHFR (0.36) ALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL9277000 0.74 LIPG (0.43) NR1H2NR1H3LIPGALDH1A1CYP2D6
SCHEMBL2959111 0.74 ALDH1A1 (0.34) ALDH1A1
SCHEMBL9162757 0.73 DRD2 (0.44) ELANECTSGNR1H2NR1H3LIPG
SCHEMBL2967208 0.72 NR1H2 (0.32) NR1H2NR1H3LIPG
SCHEMBL2969356 0.71 FABP4 (0.36) ALDH1A1
SCHEMBL2970869 0.69 NR1H2 (0.32) NR1H2NR1H3LIPG

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 ELANE 829/4885CTSG 2656/4885NR1H2 1227/4885

“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.