SCHEMBL17045815

SCHEMBL17045815

CC1(C)OB(c2c(CNC3CCCCC3)ccc3ccccc23)OC1(C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
LMNA P02545 3/20 0.44
HTT P42858 3/20 0.44
CXCR4 P61073 1/20 0.41
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 1/20 0.41
USP2 O75604 1/20 0.37
PABPC1 P11940 1/20 0.37
KDM4E B2RXH2 3/20 0.36
PKM P14618 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 3/20 0.36
GAA P10253 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
EPHX1 P07099 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL17065250 0.83 RAB9A (0.36) ALDH1A1
SCHEMBL17045814 0.79 KMT2A (0.43) KMT2ALMNAHTTCXCR4ALDH1A1
SCHEMBL775430 0.78 KDM4E (0.36) KMT2AHTTALDH1A1KDM4EMEN1
SCHEMBL16176982 0.78 LPL (0.36) KMT2ALMNAHTTALDH1A1ALOX15
SCHEMBL26621923 0.76 LPL (0.41) KMT2ALMNAHTTALDH1A1KDM4E
SCHEMBL12822400 0.76 MEN1 (0.41) KMT2AALDH1A1KDM4EMEN1GAA
SCHEMBL12822237 0.76 NFKB1 (0.40) KMT2AALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL775018 0.75 LPL (0.40) KMT2ALMNAALDH1A1KDM4EGAA
SCHEMBL18662581 0.75 LPL (0.40) KMT2ALMNAALDH1A1KDM4EGAA
SCHEMBL774936 0.75 ALDH1A1 (0.41) KMT2ALMNAHTTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108137730-B Polymerization process using pyridyldiamido compound supported on organoaluminum-treated layered silicate support 埃克森美孚化学专利公司 2021-10-29 CN disclosed
US-10676547-B2 Aluminum alkyls with pendant olefins on clays EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-06-09 US disclosed
US-20180201700-A1 Aluminum Alkyls with Pendant Olefins on Clays EXXONMOBIL CHEMICAL PATENTS INC. 2018-07-19 US disclosed
EP-3344385-A1 ALUMINUM ALKYLS WITH PENDANT OLEFINS ON CLAYS ExxonMobil Chemical Patents Inc. (US) 2018-07-11 EP disclosed
US-9982067-B2 Polymerization process using pyridyldiamido compounds supported on organoaluminum treated layered silicate supports EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-05-29 US disclosed
US-20170088641-A1 Polymerization Process Using Pyridyldiamido Compounds Supported on Organoaluminum Treated Layered Silicate Supports EXXONMOBIL CHEMICAL PATENTS INC. 2017-03-30 US disclosed
WO-2017039994-A1 ALUMINUM ALKYLS WITH PENDANT OLEFINS ON CLAYS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-03-09 WO disclosed
EP-3114130-A1 PYRIDYLDIAMIDO TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2017-01-11 EP disclosed
US-9315526-B2 Pyridyldiamido transition metal complexes, production and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2016-04-19 US disclosed
WO-2015134213-A1 PYRIDYLDIAMIDO TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2015-09-11 WO disclosed
US-20150246982-A1 Pyridyldiamido Transition Metal Complexes, Production and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2015-09-03 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-20150246982-A1 Pyridyldiamido Transition Metal Complexes, Production and Use Thereof PNPO, PARN, PPOX KMT2A 3479/4885LMNA 1780/4885HTT 3867/4885

“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.