SCHEMBL3911047

SCHEMBL3911047

CC(=O)N(Br)c1ccc(C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
ALOX15 P16050 1/20 0.52
TP53 P04637 1/20 0.50
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
POLB P06746 2/20 0.47
NPC1 O15118 1/20 0.47
SRD5A2 P31213 3/20 0.47
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA12 O43570 1/20 0.43
CA3 P07451 1/20 0.43
TYR P14679 1/20 0.43
DRD1 P21728 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA5A P35218 1/20 0.43
CA7 P43166 1/20 0.43

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
SCHEMBL28241919 0.85 MAPT (0.48) KMT2AMEN1POLBNPC1ALDH1A1
SCHEMBL5167275 0.80 NPSR1 (0.46) TSHRTP53KMT2AMEN1POLB
SCHEMBL976776 0.78 TSHR (0.55) TSHRALOX15TP53KMT2AMEN1
SCHEMBL3130237 0.78 NPC1 (0.50) TSHRALOX15TP53KMT2AMEN1
SCHEMBL8953838 0.77 POLB (0.53) TSHRALOX15TP53KMT2AMEN1
SCHEMBL4873905 0.75 TSHR (0.50) TSHRALOX15TP53KMT2AMEN1
SCHEMBL11517667 0.75 TSHR (0.50) TSHRALOX15TP53KMT2AMEN1
Terephthalic Acid SCHEMBL2187152 0.75 TSHR (0.63) TSHRALOX15TP53KMT2AMEN1
Terephthalic Acid SCHEMBL3045633 0.74 TSHR (0.80) TSHRALOX15TP53SRD5A2ALDH1A1
Terephthalic Acid SCHEMBL8209798 0.74 TSHR (0.80) TSHRALOX15TP53POLBSRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921515-B2 Methods and compositions of preparation for proteome analysis CASE WESTERN RESERVE UNIVERSITY (US) 2014-12-30 US disclosed
US-20130172539-A1 METHODS AND COMPOSITIONS OF PREPARATION FOR PROTEOME ANALYSIS CASE WESTERN RESERVE UNIVERSITY (US) 2013-07-04 US disclosed
EP-1686188-B1 Thin membrane for measuring protease activity FUJIFILM CORP (JP) 2009-03-18 EP disclosed
EP-1270736-B1 FILMS FOR ASSAYING PROTEASE ACTIVITY FUJIFILM CORP (JP) 2009-03-11 EP disclosed
EP-1686188-A1 Thin membrane for measuring protease activity Fuji Photo Film Co. Ltd. (JP) 2006-08-02 EP disclosed
US-7067272-B2 Thin membrane for measuring protease activity FUJI PHOTO FILM CO., LTD. (JP) 2006-06-27 US disclosed
US-20030148399-A1 Film for assaying protease activity FUJIFILM CORPORATION (JP) 2003-08-07 US disclosed
EP-1270736-A1 FILMS FOR ASSAYING PROTEASE ACTIVITY FUJI PHOTO FILM CO., LTD. (JP) 2003-01-02 EP disclosed
US-4536346-A TREATMENT OF ATHEROSCLEROSIS AMERICAN CYANAMID COMPANY (US) 1985-08-20 US disclosed
EP-0124791-A1 Aralkanamidophenyl compounds AMERICAN CYANAMID COMPANY (US) 1984-11-14 EP disclosed