SCHEMBL7108008

SCHEMBL7108008

CCCCC(CCC)NCC

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.36
TSHR P16473 4/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP3A4 P08684 1/20 0.36
SLC2A1 P11166 1/20 0.34
PLA2G2C Q5R387 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA1 P00915 3/20 0.31
CA2 P00918 3/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FDPS P14324 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
EPHX1 P07099 1/20 0.31
LMNA P02545 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
SCHEMBL27299573 1.00 DNM1 (0.36) DNM1TSHRALDH1A1CYP3A4SLC2A1
SCHEMBL5358878 0.95 DNM1 (0.39) DNM1TSHRALDH1A1CYP3A4SLC2A1
SCHEMBL22602 0.90 LMNA (0.39) DNM1TSHRFDPSEPHX1LMNA
SCHEMBL5359912 0.89 SLC6A4 (0.32) TSHRSIGMAR1
Hydrochloric Acid SCHEMBL28410950 0.88 LMNA (0.38) DNM1TSHRFDPSEPHX1LMNA
SCHEMBL24870689 0.87 DNM1 (0.46) DNM1TSHRPLA2G2CCA2FDPS
SCHEMBL16649197 0.86 OPRM1 (0.42) DNM1TSHRALDH1A1FDPSEPHX1
SCHEMBL9852681 0.84 LMNA (0.42) DNM1TSHRFDPSEPHX1LMNA
SCHEMBL6900932 0.84 LMNA (0.42) DNM1TSHRFDPSEPHX1LMNA
SCHEMBL2328457 0.84 LMNA (0.42) DNM1TSHRFDPSEPHX1LMNA

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
WO-2023091707-A1 BICYCLIC INHIBITORS OF JAK AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-05-25 WO disclosed
US-10564980-B2 Apparatus, methods, and systems for conditional queues in a configurable spatial accelerator INTEL CORPORATION (US) 2020-02-18 US disclosed
US-20190303168-A1 APPARATUS, METHODS, AND SYSTEMS FOR CONDITIONAL QUEUES IN A CONFIGURABLE SPATIAL ACCELERATOR INTEL CORPORATION 2019-10-03 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
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