SCHEMBL2959346

SCHEMBL2959346

Brc1c(C2C=Cc3ccccc32)ccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
ALDH1A1 P00352 4/20 0.34
HSD17B10 Q99714 3/20 0.34
CYP2A6 P11509 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
KDM1A O60341 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
APAF1 O14727 1/20 0.34
NPC1 O15118 1/20 0.34
HPRT1 P00492 1/20 0.32
NCEH1 Q6PIU2 3/20 0.32
CYP1A2 P05177 2/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
CYP1B1 Q16678 1/20 0.31
THRB P10828 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
SCHEMBL1025256 0.84 KDM1A (0.43) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL2962765 0.84 CYP2A6 (0.39) CYP2A6TDP1MEN1KMT2ANPC1
SCHEMBL2970622 0.83 CYP1A2 (0.38) ALDH1A1HSD17B10CYP2A6TDP1CYP1A2
SCHEMBL2970909 0.81 CYP2A6 (0.39) ALDH1A1CYP2A6MEN1KMT2ANPSR1
SCHEMBL2963823 0.80 CYP1A2 (0.38) ALDH1A1CYP2A6CYP1A2
SCHEMBL2972957 0.79 ALDH1A1 (0.33) POLBALDH1A1HSD17B10CYP2A6TSHR
SCHEMBL2959129 0.79 MEN1 (0.31) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL2973806 0.79 CYP1A2 (0.31) POLBCYP2A6CYP1A2
SCHEMBL3213154 0.77 PIM1 (0.36) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL2971252 0.76 KDM1A (0.37) ALDH1A1CYP2A6KDM1AMEN1KMT2A

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 POLB 2658/4885ALDH1A1 4332/4885HSD17B10 4474/4885

“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.