SCHEMBL2964848

SCHEMBL2964848

FC(F)(F)c1ccccc1-c1[c]c2c(cc1)-c1ccccc1C2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GALR1 P47211 1/20 0.35
MAOA P21397 1/20 0.34
HSD11B1 P28845 2/20 0.34
AR P10275 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NOTUM Q6P988 2/20 0.33
BCHE P06276 1/20 0.33
CES1 P23141 1/20 0.33
TRPA1 O75762 1/20 0.31
CYP1A2 P05177 3/20 0.31
CYP2C19 P33261 3/20 0.31

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
SCHEMBL2974521 0.80 KDM4E (0.36) GALR1MAOAALDH1A1HPGDKDM4E
SCHEMBL2962089 0.79 KDM4E (0.38) MAOAARHTR2CALDH1A1HPGD
SCHEMBL2975649 0.77 TRPA1 (0.34) GALR1MAOAHSD11B1ARHTR2A
SCHEMBL313500 0.76 PNMT (0.44) MAOAHTR2AHTR2CALDH1A1HPGD
SCHEMBL2965677 0.76 ALDH1A1 (0.36) GALR1MAOAALDH1A1HPGDKDM4E
SCHEMBL217877 0.76 ALDH1A1 (0.36) GALR1MAOAHTR2CALDH1A1HPGD
SCHEMBL2971770 0.76 KDM4E (0.33) MAOAALDH1A1HPGDKDM4ENPC1
SCHEMBL2972402 0.76 KDM4E (0.33) MAOAALDH1A1HPGDKDM4ENPC1
SCHEMBL216860 0.76 ALDH1A1 (0.38) MAOAHTR2CALDH1A1HPGDKDM4E
SCHEMBL2974781 0.75 KDM4E (0.35) MAOAALDH1A1HPGDKDM4ENPC1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7763562-B2 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-07-27 US disclosed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 US disclosed
US-7214747-B2 Phosphorus substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-08 US disclosed
US-7214746-B2 Phosphorus bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-08 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed
US-20050239981-A1 Phosphorus bridged metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2005-10-27 US disclosed
US-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2005-10-27 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 (3 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-20050239981-A1 Phosphorus bridged metallocene compounds for olefin polymerization PYM1, ZNF207, POLL GALR1 1758/4885MAOA 3087/4885HSD11B1 4589/4885
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 GALR1 992/4885MAOA 958/4885HSD11B1 4377/4885
US-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization CCRL2, ARL1, OSBP2 GALR1 1080/4885MAOA 4430/4885HSD11B1 3445/4885

“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.