SCHEMBL2967402

SCHEMBL2967402

CC1=CCc2c1ccc(-c1ccccc1C)c2Br

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
HTR7 P34969 1/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
CASP3 P42574 2/20 0.32
SENP8 Q96LD8 2/20 0.32
SENP7 Q9BQF6 2/20 0.32
SENP6 Q9GZR1 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TSHR P16473 2/20 0.31
NISCH Q9Y2I1 1/20 0.31
BRD4 O60885 1/20 0.30
ACHE P22303 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
SCHEMBL2965357 0.87
SCHEMBL2973175 0.81 ALDH1A1 (0.36) ALDH1A1NPC1RAB9ACASP3SENP8
SCHEMBL2963790 0.81 CA12 (0.36) ALDH1A1HTR7SMN1; SMN2NISCHBRD4
SCHEMBL2962632 0.81 ALDH1A1 (0.36) ALDH1A1
SCHEMBL2958875 0.80 ADRA2A (0.31)
SCHEMBL2970803 0.78 NPC1 (0.33) ALDH1A1HTR7NPC1RAB9ACASP3
SCHEMBL2962738 0.77 ADORA1 (0.32) ALDH1A1HTR7NPC1RAB9ACASP3
SCHEMBL2960703 0.77 ALDH1A1 (0.35) ALDH1A1HTR7NPC1RAB9ACASP3
SCHEMBL2975356 0.76 GPR3 (0.33)
SCHEMBL21694427 0.75 ACHE (0.41) ALDH1A1TSHRACHE

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 4332/4885HTR7 2417/4885NPC1 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.