SCHEMBL2969762

SCHEMBL2969762

CC1C=C(c2ccccc2)c2c(Br)cccc21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
MAPK1 P28482 2/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PBRM1 Q86U86 1/20 0.34
FABP4 P15090 1/20 0.33
GID4 Q8IVV7 1/20 0.32
KDM1A O60341 1/20 0.31
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 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
SCHEMBL2958997 0.86 NPC1 (0.33) ALDH1A1MAPK1NPC1RAB9APBRM1
SCHEMBL2975774 0.78 PTPN1 (0.36) ALDH1A1MAPK1NPC1RAB9APBRM1
SCHEMBL2957965 0.77 PBRM1 (0.34) ALDH1A1PBRM1
SCHEMBL2957356 0.76 ALDH1A1 (0.32) ALDH1A1MAPK1NPC1RAB9APBRM1
SCHEMBL2975584 0.76 PBRM1 (0.36) ALDH1A1PBRM1
SCHEMBL2970600 0.76 PBRM1 (0.36) ALDH1A1PBRM1
SCHEMBL6627745 0.73 ALDH1A1 (0.37) ALDH1A1MAPK1MEN1KMT2A
SCHEMBL2958513 0.73 BCHE (0.33)
SCHEMBL2972664 0.71 MAPK1 (0.45) ALDH1A1MAPK1RAB9AMAPT
SCHEMBL2973762 0.70 MAPK1 (0.40) ALDH1A1MAPK1NPC1RAB9AKDM4E

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 ALDH1A1 4332/4885MAPK1 3118/4885NPC1 4083/4885

“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.