SCHEMBL2968049

SCHEMBL2968049

Brc1cc2ccccc2c2c1C=CC2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 2/20 0.38
HIF1A Q16665 1/20 0.38
CYP1B1 Q16678 1/20 0.38
KDM4E B2RXH2 2/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
ATM Q13315 1/20 0.34
TSHR P16473 1/20 0.33
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TRPM4 Q8TD43 1/20 0.31
ALOX5 P09917 1/20 0.30
CYP1A2 P05177 1/20 0.30
HPGD P15428 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
SCHEMBL2967846 0.86 ALDH1A1 (0.38) ALDH1A1HSD17B10HIF1ACYP1B1KDM4E
SCHEMBL4405538 0.75 ERN1 (0.41) ALDH1A1KDM4EATMTSHRMEN1
SCHEMBL2959810 0.74 DHFR (0.36) ALDH1A1HSD17B10KDM4ECYP2D6CYP2C19
SCHEMBL2972198 0.72 CYP1A2 (0.36) ALDH1A1HSD17B10KDM4ECYP2C19MAPT
SCHEMBL2959311 0.71 POLB (0.36) ALDH1A1HSD17B10HIF1ACYP1B1TRPM4
SCHEMBL2974869 0.71 POLB (0.36) ALDH1A1HSD17B10HIF1ACYP1B1MEN1
SCHEMBL8368595 0.71 PAX8 (0.47) ALDH1A1HSD17B10HIF1AKDM4ECYP2D6
SCHEMBL30627931 0.70
SCHEMBL302728 0.70
SCHEMBL30676994 0.70

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 ALDH1A1 4332/4885HSD17B10 4474/4885HIF1A 4542/4885

“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.