SCHEMBL1629686

SCHEMBL1629686

COc1c(-c2cccc3c2C(C)(C)c2ccccc2-3)cc(C)cc1C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
MDM2 Q00987 1/20 0.34
PDK2 Q15119 5/20 0.34
EGFR P00533 1/20 0.34
ERBB2 P04626 1/20 0.34
TNFRSF1A P19438 1/20 0.32
PGR P06401 1/20 0.30
CA2 P00918 1/20 0.30
POLB P06746 1/20 0.30
TYR P14679 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL14782115 0.73 PDK2 (0.38) PDK2EGFRERBB2
SCHEMBL18926392 0.69 CA2 (0.57) ALDH1A1SMN1; SMN2LMNACA2POLB
SCHEMBL5857102 0.69 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2LMNATNFRSF1ACA2
SCHEMBL25841356 0.69 PGR (0.41) ALDH1A1SMN1; SMN2KDM4ELMNAMDM2
SCHEMBL27724351 0.68 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2KDM4ELMNAMDM2
SCHEMBL15853193 0.68 PDK2 (0.39) PDK2PGR
SCHEMBL1627404 0.68 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2PDK2CA2POLB
SCHEMBL24122896 0.67 NQO2 (0.37) ALDH1A1SMN1; SMN2KDM4EPDK2PGR
SCHEMBL18926391 0.67 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2LMNACA2POLB
SCHEMBL16766189 0.67 PDK2 (0.45) ALDH1A1SMN1; SMN2KDM4ELMNAMDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232359-B2 Process for preparing ethylene homopolymers or copolymers of ethylene with α-olefin by using the transition metal compound SK INNOVATION CO., LTD. (KR) 2012-07-31 US disclosed
US-20110319576-A1 PROCESS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE WITH ALPHA-OLEFIN BY USING THE TRANSITION METAL COMPOUND SK ENERGY CO., LTD. (KR) 2011-12-29 US disclosed
EP-2326654-A2 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND - OLEFINS USING THE SAME. SK Energy Co., Ltd. (KR) 2011-06-01 EP disclosed
US-20110098426-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF THE ETHYLENE AND a-OLEFINS USING THE SAME SK ENERGY CO., LTD. (KR) 2011-04-28 US disclosed
US-7928173-B2 Transition metal catalytic systems and methods for preparing ethylene homopolymers or copolymers of ethylene and α-olefins using the same SK ENERGY CO., LTD. (KR) 2011-04-19 US disclosed
US-20100081776-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND a-OLEFINS USING THE SAME SABIC SK NEXLENE COMPANY PTE. LTD. (SG) 2010-04-01 US disclosed
WO-2010036025-A2 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND α- OLEFINS USING THE SAME. SK ENERGY CO., LTD. (KR) 2010-04-01 WO 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 (2 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-20100081776-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND a-OLEFINS USING THE SAME ESR1, AOC3, PPOX ALDH1A1 1685/4885SMN1; SMN2 1853/4885KDM4E 934/4885
US-20110098426-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF THE ETHYLENE AND a-OLEFINS USING THE SAME ESR1, AOC3, AOC2 ALDH1A1 1883/4885SMN1; SMN2 1999/4885KDM4E 868/4885

“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.