SCHEMBL3678840

SCHEMBL3678840

COc1ccccc1Nc1ccccc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.56
JAK3 P52333 1/20 0.56
MAPT P10636 10/20 0.53
ALDH1A1 P00352 8/20 0.53
GAA P10253 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
MAPK1 P28482 5/20 0.53
KDM4E B2RXH2 5/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
POLB P06746 2/20 0.53
HTT P42858 2/20 0.51
FABP4 P15090 3/20 0.50
KMT2A Q03164 3/20 0.50
LMNA P02545 2/20 0.50
FABP3 P05413 2/20 0.50
FABP5 Q01469 2/20 0.50
MEN1 O00255 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
ABCG2 Q9UNQ0 1/20 0.50

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
SCHEMBL3191755 0.84 MAPT (0.69) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL18542335 0.82 ALDH1A1 (0.60) MAPTALDH1A1GAANPC1KDM4E
SCHEMBL5923798 0.82 MAPT (0.67) MAPTALDH1A1GAANPC1RAB9A
SCHEMBL29574036 0.82 FABP3 (0.67) MAPTALDH1A1MAPK1L3MBTL1HTT
SCHEMBL2437912 0.82 FABP3 (0.67) MAPTALDH1A1MAPK1L3MBTL1HTT
SCHEMBL15605284 0.80 FABP3 (0.64) MAPTALDH1A1MAPK1L3MBTL1HTT
SCHEMBL18934637 0.78 FABP3 (0.50) JAK2JAK3MAPTALDH1A1KDM4E
SCHEMBL5370631 0.78 FABP3 (0.62) ALDH1A1MAPK1FABP4KMT2ALMNA
SCHEMBL294721 0.78 ALDH1A1 (0.58) ALDH1A1GAANPC1RAB9AMAPK1
SCHEMBL30136447 0.78 ALDH1A1 (0.58) ALDH1A1GAANPC1RAB9AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9371422-B2 Titanium containing complex and condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2016-06-21 US disclosed
US-9371422-B2 Titanium containing complex and condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2016-06-21 US disclosed
US-9328205-B2 Iron(III) containing complex and condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2016-05-03 US disclosed
US-9328205-B2 Iron(III) containing complex and condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2016-05-03 US disclosed
EP-2087011-B1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND OLEFINS USING THE SAME SK INNOVATION CO LTD (KR) 2015-09-16 EP disclosed
US-20140371056-A1 Iron(III) Containing Complex and Condensation Reaction Catalysts, Methods for Preparing the Catalysts, and Compositions Containing the Catalysts DOW COMING CORPORATION (US) 2014-12-18 US disclosed
US-20140371056-A1 Iron(III) Containing Complex and Condensation Reaction Catalysts, Methods for Preparing the Catalysts, and Compositions Containing the Catalysts DOW COMING CORPORATION (US) 2014-12-18 US disclosed
US-20140213690-A1 Titanium Containing Complex and Condensation Reaction Catalysts, Methods for Preparing the Catalysts, and Compositions Containing the Catalysts DOW CORNING CORPORATION (US) 2014-07-31 US disclosed
US-20140213690-A1 Titanium Containing Complex and Condensation Reaction Catalysts, Methods for Preparing the Catalysts, and Compositions Containing the Catalysts DOW CORNING CORPORATION (US) 2014-07-31 US disclosed
US-8742043-B2 Transition metal catalytic systems and methods for preparing ethylene homopolymers or copolymers of ethylene and olefins using the same SK INNOVATION CO., LTD. (KR) 2014-06-03 US disclosed
WO-2013052585-A2 IRON(III) CONTAINING COMPLEX AND CONDENSATION REACTION CATALYSTS, METHODS FOR PREPARING THE CATALYSTS, AND COMPOSITIONS CONTAINING THE CATALYSTS DOW CORNING CORPORATION (US) 2013-04-11 WO disclosed
WO-2013036546-A2 TITANIUM CONTAINING COMPLEX AND CONDENSATION REACTION CATALYSTS, METHODS FOR PREPARING THE CATALYSTS, AND COMPOSITIONS CONTAINING THE CATALYSTS DOW CORNING CORPORATION (US) 2013-03-14 WO disclosed
US-20100048840-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND OLEFINS USING THE SAME SK INNOVATION CO., LTD. (KR) 2010-02-25 US disclosed
EP-2087011-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND OLEFINS USING THE SAME SK Energy Co., Ltd. (KR) 2009-08-12 EP disclosed
WO-2008054117-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND OLEFINS USING THE SAME SK ENERGY CO., LTD. (KR) 2008-05-08 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 (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-20100048840-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND OLEFINS USING THE SAME MCM4, ETV6, HMBS JAK2 4299/4885JAK3 3722/4885MAPT 3459/4885

“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.