SCHEMBL2964207

SCHEMBL2964207

[N]Cc1ccccc1C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.55
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
ATM Q13315 1/20 0.46
MAOB P27338 4/20 0.44
MAOA P21397 1/20 0.44
POLB P06746 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
POLQ O75417 1/20 0.42
DAO P14920 1/20 0.41
AR P10275 1/20 0.40

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
SCHEMBL3647884 0.80 IDO1 (0.59) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL17329111 0.80 IDO1 (0.59) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL2097721 0.78 IDO1 (0.57) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL29389277 0.78 IDO1 (0.57) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL4527 0.78 IDO1 (0.57) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL44837 0.78 IDO1 (0.57) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL29427013 0.78 IDO1 (0.57) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL23337251 0.76 IDO1 (0.55) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL14162147 0.76 IDO1 (0.55) IDO1ALDH1A1KDM4EATMMAOB
SCHEMBL20083527 0.76 IDO1 (0.55) IDO1ALDH1A1KDM4EATMMAOB

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 IDO1 1090/4885ALDH1A1 4332/4885KDM4E 2177/4885

“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.