SCHEMBL4280939

SCHEMBL4280939

NCCCCOC(=O)c1ccccc1C(=O)O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.60
CYP3A4 P08684 3/20 0.60
MAPK1 P28482 3/20 0.60
TP53 P04637 2/20 0.60
ALDH1A1 P00352 9/20 0.58
LMNA P02545 1/20 0.58
TDP1 Q9NUW8 5/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
HSD17B10 Q99714 4/20 0.51
KDM4E B2RXH2 2/20 0.51
POLB P06746 1/20 0.51
ALOX15 P16050 1/20 0.47
NPC1 O15118 3/20 0.46
HPGD P15428 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GLA P06280 1/20 0.46
HIF1A Q16665 1/20 0.46
MEN1 O00255 1/20 0.45
NFKB1 P19838 1/20 0.45

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
SCHEMBL5709795 0.91 TSHR (0.70) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL1395556 0.90 ALDH1A1 (0.71) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL28188145 0.90 ALDH1A1 (0.71) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL28214845 0.88 ALDH1A1 (0.61) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL27446307 0.88 TSHR (0.67) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL1513877 0.85 TSHR (0.62) TSHRCYP3A4MAPK1TP53ALDH1A1
Decylamine SCHEMBL27412164 0.84 ALDH1A1 (0.84) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL3302489 0.84 ALDH1A1 (0.69) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL29721258 0.83 TSHR (0.87) TSHRCYP3A4MAPK1TP53ALDH1A1
SCHEMBL57860 0.83 TSHR (0.87) TSHRCYP3A4MAPK1TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035459-B1 COVALENT CONJUGATES OF COTTON AND SUBSTITUTES (VISCOSE, MODAL COTTON) WITH BIOACTIVE SUBSTANCES HAVING ANTISEPTIC, SANITIZING, ACARICIDAL AND INSECT REPELLENT ACTIVITY, AND A METHOD FOR OBTAINING THEM FRANZONI FILATI S P A (IT) 2009-12-16 EP disclosed
US-20090130187-A1 Covalent Conjugates of Cotton and Substitutes (Viscose, Modal Cotton) with Bioactive Substances Having Antiseptic, Sanitizing, Acaricidal and Insect Repellent Activity, and a Method for Obtaining Them FRANZONI FILATI S.P.A. (IT) 2009-05-21 US disclosed
EP-2035459-A2 COVALENT CONJUGATES OF COTTON AND SUBSTITUTES (VISCOSE, MODAL COTTON) WITH BIOACTIVE SUBSTANCES HAVING ANTISEPTIC, SANITIZING, ACARICIDAL AND INSECT REPELLENT ACTIVITY, AND A METHOD FOR OBTAINING THEM Franzoni Filati S.p.A. (IT) 2009-03-18 EP disclosed
WO-2007135548-A2 COVALENT CONJUGATES OF COTTON AND SUBSTITUTES (VISCOSE, MODAL COTTON) WITH BIOACTIVE SUBSTANCES HAVING ANTISEPTIC, SANITIZING, ACARICIDAL AND INSECT REPELLENT ACTIVITY, AND A METHOD FOR OBTAINING THEM FRANZONI FILATI S.P.A. (IT) 2007-11-29 WO disclosed