SCHEMBL2973456

SCHEMBL2973456

CC1C=Cc2c1ccc(-c1cccc3ccccc13)c2Br

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTR1A P08908 2/20 0.32
HTR7 P34969 2/20 0.32
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
POLB P06746 2/20 0.31
ALOX15 P16050 2/20 0.31
ALDH1A1 P00352 2/20 0.31
CYP2A6 P11509 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
DHFR P00374 1/20 0.31
MAOA P21397 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
SCHEMBL2974318 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL2963873 0.81 DHFR (0.35) MAPTNPC1RAB9ASMN1; SMN2CA12
SCHEMBL2975307 0.80 TRPM2 (0.36) MAPTNPC1RAB9ASMN1; SMN2HTR1A
SCHEMBL2972559 0.79 ALDH1A1 (0.34) MAPTNPC1RAB9ASMN1; SMN2HTR1A
SCHEMBL2973463 0.78 ALDH1A1 (0.34) ALDH1A1MAPK1
SCHEMBL2970659 0.78 CYP1A2 (0.34) MAPTNPC1RAB9ASMN1; SMN2HTR1A
SCHEMBL2972117 0.78 CYP1A2 (0.34) MAPTNPC1RAB9ASMN1; SMN2HTR1A
SCHEMBL2968832 0.78
SCHEMBL5702772 0.77 ALDH1A1 (0.41) MAPTCA12CA9POLBALDH1A1
SCHEMBL2965212 0.76 CHRNA1 (0.36) MAPTNPC1RAB9ASMN1; SMN2CA12

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 2 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

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 MAPT 206/4885NPC1 4083/4885RAB9A 1848/4885

“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.