SCHEMBL7031486

SCHEMBL7031486

CCCC(C)CCCNCC

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
CYP2C19 P33261 2/20 0.48
MEN1 O00255 1/20 0.48
GLA P06280 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP1A2 P05177 1/20 0.46
KDM1A O60341 5/20 0.39
SAT1 P21673 2/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.35
ACE2 Q9BYF1 1/20 0.32
TP53 P04637 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
SCHEMBL13339807 0.93 TSHR (0.50) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL22239268 0.91 TSHR (0.48) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL19731211 0.91 TSHR (0.48) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL20724921 0.91 TSHR (0.59) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL5932832 0.90 TSHR (0.46) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL25906760 0.86 TSHR (0.42) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL25667787 0.86 TSHR (0.42) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL20629301 0.85 TSHR (0.43) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL21754098 0.85 TSHR (0.43) TSHRCYP2C19MEN1GLAKMT2A
SCHEMBL7100023 0.85 TSHR (0.43) TSHRCYP2C19MEN1GLAKMT2A

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
WO-2023189803-A1 RESIST UNDERLAYER FILM FORMING COMPOSITION 日産化学株式会社 2023-10-05 WO disclosed
WO-2023189799-A1 SELF CROSS-LINKABLE POLYMER AND RESIST UNDERLAYER FILM-FORMING COMPOSITION 日産化学株式会社 2023-10-05 WO disclosed
WO-2021146548-A1 UNIVERSAL DYNAMIC PHARMACOKINETIC-MODIFYING ANCHORS KHVOROVA ANASTASIA (US) 2021-07-22 WO disclosed
WO-2020204647-A1 PROCESSES FOR PREPARING (3R,4R)-1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE OR A SALT THEREOF AND PROCESSES FOR PREPARING TOFACITINIB USING THE SAME YUHAN CORPORATION (KR) 2020-10-08 WO disclosed
US-10718733-B2 Methods and apparatus for measuring analytes Life Technologies Corporation (US) 2020-07-21 US disclosed
EP-1290002-A1 CHEMICAL PRODUCTS SUITED FOR USE AS CO-CATALYSTS, METHOD FOR THE PREPARATION THEREOF AND THEIR USE IN CATALYST SYSTEMS FOR PRODUCING POLYOLEFINS Basell Polyolefine GmbH (DE) 2003-03-12 EP disclosed
EP-1280600-A2 SUPPORTED CATALYST SYSTEM COMPRISING A METALLOCENE, A LEWIS-BASE AND AN ORGANODEMENTAL COMPOUND OF MAIN GROUP III, AND ITS USE Basell Polypropylen GmbH (DE) 2003-02-05 EP disclosed
EP-1250363-A2 CHEMICAL COMPOUND, METHOD FOR THE PRODUCTION THEREOF AND ITS USE IN CATALYST SYSTEMS FOR PRODUCING POLYOLEFINS Basell Polyolefine GmbH (DE) 2002-10-23 EP disclosed
WO-2001090112-A1 CHEMICAL PRODUCTS SUITED FOR USE AS CO-CATALYSTS, METHOD FOR THE PREPARATION THEREOF AND THEIR USE IN CATALYST SYSTEMS FOR PRODUCING POLYOLEFINS BASELL POLYOLEFINE GMBH (DE) 2001-11-29 WO disclosed
WO-2001047635-A2 SUPPORTED CATALYST SYSTEM CONTAINING A METALLOCENE, A LEWIS BASE AND AN ELEMENTALLY ORGANIC COMPOUND OF MAIN GROUP III AND THE USE THEREOF BASELL POLYPROPYLEN GMBH (DE) 2001-07-05 WO disclosed
WO-2001048035-A2 CHEMICAL COMPOUND, METHOD FOR THE PRODUCTION THEREOF AND ITS USE IN CATALYST SYSTEMS FOR PRODUCING POLYOLEFINS BASELL POLYOLEFINE GMBH (DE) 2001-07-05 WO disclosed