SCHEMBL2971197

SCHEMBL2971197

C1=Cc2ccccc2[C]1c1cccs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.40
ALDH1A1 P00352 9/20 0.40
SMN1; SMN2 Q16637 7/20 0.40
RAB9A P51151 7/20 0.40
LTA4H P09960 1/20 0.40
NPC1 O15118 6/20 0.38
TDP1 Q9NUW8 2/20 0.38
MAPK1 P28482 1/20 0.38
PTAFR P25105 1/20 0.38
LTK P29376 1/20 0.38
CDK5 Q00535 1/20 0.38
MST1R Q04912 1/20 0.38
DYRK1A Q13627 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
HSD17B10 Q99714 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ADORA3 P0DMS8 1/20 0.37
USP2 O75604 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37

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
SCHEMBL5921807 0.75 LMNA (0.50) KDM4EALDH1A1HSD17B10MEN1KMT2A
SCHEMBL995326 0.73 LTA4H (0.55) KDM4EALDH1A1SMN1; SMN2RAB9ALTA4H
SCHEMBL28025964 0.72 ALDH1A1 (0.41) KDM4EALDH1A1SMN1; SMN2RAB9ALTA4H
SCHEMBL2975488 0.72 ALDH1A1 (0.41) KDM4EALDH1A1SMN1; SMN2RAB9ALTA4H
Hydrogen Sulfide SCHEMBL752785 0.71 LTA4H (0.53) KDM4EALDH1A1SMN1; SMN2RAB9ALTA4H
SCHEMBL2964840 0.69 LTA4H (0.41) KDM4EALDH1A1SMN1; SMN2RAB9ALTA4H
SCHEMBL2975867 0.69 PTPRC (0.40) KDM4EALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL6228215 0.68 LTA4H (0.47) KDM4EALDH1A1SMN1; SMN2RAB9ALTA4H
SCHEMBL3626478 0.68 RAB9A (0.61) KDM4EALDH1A1SMN1; SMN2RAB9ALTA4H
SCHEMBL11084798 0.68 LTK (0.49) KDM4EALDH1A1LTA4HTDP1PTAFR

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 KDM4E 1418/4885ALDH1A1 4206/4885SMN1; SMN2 4049/4885
US-20070135597-A1 Heteroatom bridged metallocene compounds for olefin polymerization AP2M1, AP1M1, PYM1 KDM4E 2177/4885ALDH1A1 4332/4885SMN1; SMN2 4156/4885
US-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization CCRL2, ARL1, OSBP2 KDM4E 3216/4885ALDH1A1 4248/4885SMN1; SMN2 4055/4885

“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.