SCHEMBL773437

SCHEMBL773437

CC1(C)OB(c2c(CN(C(=O)O)c3ccccc3)ccc3ccccc23)OC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 6/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 3/20 0.34
TSHR P16473 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
CFTR P13569 1/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ROCK1 Q13464 1/20 0.33
HTT P42858 2/20 0.33
ATM Q13315 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33

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
SCHEMBL776130 0.86 CTSS (0.35) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL26621923 0.78 LPL (0.41) KMT2AALDH1A1KDM4EHPGDTSHR
SCHEMBL2377873 0.78 CXCR2 (0.37) MEN1KMT2AALDH1A1TSHRHTT
SCHEMBL12822400 0.77 MEN1 (0.41) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL12822172 0.75 GPR55 (0.42) LPLLIPG
SCHEMBL775018 0.74 LPL (0.40) KMT2AALDH1A1KDM4ETSHRMAPT
SCHEMBL18662581 0.74 LPL (0.40) KMT2AALDH1A1KDM4ETSHRMAPT
SCHEMBL16176982 0.72 LPL (0.36) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL17852137 0.71 MAOB (0.43) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL775430 0.69 KDM4E (0.36) MEN1KMT2AALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8710163-B2 Pyridyldiamido transition metal complexes, production and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2014-04-29 US disclosed
US-8674040-B2 Pyridyldiamido transition metal complexes, production and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2014-03-18 US disclosed
EP-2688895-A1 PYRIDYLDIAMIDO TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF Exxonmobil Chemical Patents Inc. (US) 2014-01-29 EP disclosed
EP-2688896-A2 PYRIDYLDIAMIDO TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF Exxonmobil Chemical Patents Inc. (US) 2014-01-29 EP disclosed
US-8394902-B2 Pyridyldiamido transition metal complexes, production and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-03-12 US disclosed
WO-2012134613-A2 PYRIDYLDIAMIDO TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-10-04 WO disclosed
WO-2012134615-A1 PYRIDYLDIAMIDO TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-10-04 WO disclosed
US-20120071616-A1 Pyridyldiamido Transition Metal Complexes, Production And Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2012-03-22 US disclosed
US-20110301310-A1 Pyridyldiamido Transition Metal Complexes, Production And Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-12-08 US disclosed
US-20110224391-A1 Pyridyldiamido Transition Metal Complexes, Production and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-09-15 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-20110301310-A1 Pyridyldiamido Transition Metal Complexes, Production And Use Thereof PNPO, PLPBP, PDXK MEN1 3180/4885KMT2A 3516/4885ALDH1A1 1554/4885
US-20110224391-A1 Pyridyldiamido Transition Metal Complexes, Production and Use Thereof PICALM, PARN, PCBP1 MEN1 2585/4885KMT2A 3696/4885ALDH1A1 2590/4885
US-20120071616-A1 Pyridyldiamido Transition Metal Complexes, Production And Use Thereof PNPO, PLPBP, PDXK MEN1 3180/4885KMT2A 3516/4885ALDH1A1 1554/4885

“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.