SCHEMBL2970796

SCHEMBL2970796

Brc1cc(-c2ccco2)cc2c1CC=C2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 7/20 0.37
PIK3CA P42336 7/20 0.37
TAAR1 Q96RJ0 2/20 0.35
TOP1 P11387 1/20 0.33
KEAP1 Q14145 1/20 0.33
ERN1 O75460 2/20 0.32
KDM4E B2RXH2 2/20 0.32
NPC1 O15118 2/20 0.32
MAPT P10636 2/20 0.32
RAB9A P51151 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TSHR P16473 1/20 0.32
PTPN1 P18031 1/20 0.31
PRMT6 Q96LA8 1/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 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
SCHEMBL2971181 0.76 PIK3R1 (0.35) PIK3R1PIK3CAKDM4ENPC1MAPT
SCHEMBL2963811 0.76 PIK3R1 (0.37) PIK3R1PIK3CATAAR1TOP1KEAP1
SCHEMBL2975974 0.76 CRHBP (0.46) ALDH1A1
SCHEMBL2965967 0.75 KDM4E (0.34) KDM4ENPC1RAB9AHSD17B10TSHR
SCHEMBL2974333 0.74 PIK3R1 (0.35) PIK3R1PIK3CAKDM4ENPC1MAPT
SCHEMBL2967447 0.71 PIK3R1 (0.35) PIK3R1PIK3CAKDM4ENPC1MAPT
SCHEMBL2964510 0.71 PIK3R1 (0.32) PIK3R1PIK3CAKDM4ENPC1MAPT
SCHEMBL2963593 0.70 PIK3R1 (0.37) PIK3R1PIK3CAKDM4ENPC1MAPT
SCHEMBL2967489 0.70 KCNH2 (0.36) ERN1KDM4EMAPTRAB9APTPN1
SCHEMBL2961815 0.70 PIK3R1 (0.37) PIK3R1PIK3CAKDM4ENPC1MAPT

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 PIK3R1 4861/4885PIK3CA 4295/4885TAAR1 699/4885

“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.