SCHEMBL647169

SCHEMBL647169

CCCCC1=CC=CC1=C(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.38
CES2 O00748 3/20 0.37
CES1 P23141 3/20 0.37
ESR1 P03372 1/20 0.36
ATM Q13315 1/20 0.34
LMNA P02545 1/20 0.34
NAAA Q02083 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
RGS12 O14924 1/20 0.33
APOBEC3A P31941 1/20 0.33
HTT P42858 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
AGTR1 P30556 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL645218 0.95 CES2 (0.38) PTGS2CES2CES1ESR1LMNA
SCHEMBL743415 0.76 AKT1 (0.31)
SCHEMBL27577277 0.74 ACHE (0.31)
SCHEMBL27870084 0.68 HSD11B1 (0.33) TDP1POLB
SCHEMBL28040355 0.67 ESR1 (0.33) ESR1POLB
SCHEMBL28040367 0.67 HSD11B1 (0.35) POLB
SCHEMBL647170 0.66 CES2 (0.41) PTGS2CES2CES1ESR1ATM
SCHEMBL27717977 0.64 ACHE (0.50) PTGS2
SCHEMBL27790624 0.64 ACHE (0.33) HTT
SCHEMBL27631018 0.63 ACHE (0.31)

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
EP-2201047-B1 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW MELT ELASTICITY CHEVRON PHILLIPS CHEMICAL CO (US) 2016-05-04 EP disclosed
US-8637691-B2 Polymerization catalysts for producing polymers with low melt elasticity CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2014-01-28 US disclosed
US-20130245302-A1 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW MELT ELASTICITY CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2013-09-19 US disclosed
US-8450437-B2 Polymerization catalysts for producing polymers with low melt elasticity CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2013-05-28 US disclosed
US-20120108765-A1 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW MELT ELASTICITY CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-05-03 US disclosed
US-8119553-B2 Polymerization catalysts for producing polymers with low melt elasticity CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-02-21 US disclosed
EP-2201047-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW MELT ELASTICITY Chevron Phillips Chemical Company LP (US) 2010-06-30 EP disclosed
WO-2009045301-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW MELT ELASTICITY YU YOULU (US) 2009-04-09 WO disclosed
US-20090088543-A1 Polymerization catalysts for producing polymers with low melt elasticity CHEVRON PHILLIPS CHEMICAL COMPANY LP 2009-04-02 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-20130245302-A1 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW MELT ELASTICITY MCM4, CKAP4, MDM4 PTGS2 1643/4885CES2 1485/4885CES1 4275/4885

“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.