SCHEMBL16035409

SCHEMBL16035409

COCCOc1c(Br)ccc(C(=O)Oc2c(F)c(F)c(F)c(F)c2F)c1C

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
TSHR P16473 1/20 0.34
MAPT P10636 3/20 0.32
MEN1 O00255 2/20 0.32
USP2 O75604 2/20 0.32
ALOX15 P16050 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TNFRSF1A P19438 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30
KDM4E B2RXH2 2/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL20146020 0.94 RECQL (0.34) KMT2ATSHRMAPTMEN1USP2
SCHEMBL16035002 0.85 HDAC3 (0.38) KMT2ATSHRMAPTMEN1USP2
SCHEMBL8526820 0.83 KMT2A (0.44) KMT2ATSHRMAPTMEN1USP2
SCHEMBL9733862 0.81 HSD17B10 (0.37) KMT2ATSHRMAPTUSP2L3MBTL1
SCHEMBL16035156 0.78 MEN1 (0.40) KMT2AMEN1L3MBTL1RAB9A
SCHEMBL8491964 0.72 KMT2A (0.44) KMT2ATSHRMAPTMEN1USP2
SCHEMBL16034504 0.71 TAS1R3 (0.32) KMT2AMAPTMEN1L3MBTL1RAB9A
SCHEMBL16034506 0.71 TAS1R3 (0.32) KMT2AMAPTMEN1L3MBTL1RAB9A
SCHEMBL17559391 0.71 KMT2A (0.44) KMT2ATSHRMAPTMEN1USP2
SCHEMBL587574 0.70 KMT2A (0.44) KMT2ATSHRMAPTMEN1USP2

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10851119-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2020-12-01 US disclosed
US-10851119-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2020-12-01 US disclosed
US-20200157122-A1 BORON-CONTAINING DIACYLHYDRAZINES INTREXON CORP (US) 2020-05-21 US disclosed
US-20200157122-A1 BORON-CONTAINING DIACYLHYDRAZINES INTREXON CORP (US) 2020-05-21 US disclosed
US-10464951-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2019-11-05 US disclosed
US-10464951-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2019-11-05 US disclosed
EP-2970106-B1 BORON-CONTAINING DIACYLHYDRAZINES INTREXON CORP (US) 2018-05-16 EP disclosed
US-20180079759-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION (US) 2018-03-22 US disclosed
US-20180079759-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION (US) 2018-03-22 US disclosed
US-20180079759-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION (US) 2018-03-22 US disclosed
US-20150322092-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION (US) 2015-11-12 US disclosed
US-20150322092-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION (US) 2015-11-12 US disclosed
US-9127024-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2015-09-08 US disclosed
US-9127024-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2015-09-08 US disclosed
US-9127024-B2 Boron-containing diacylhydrazines INTREXON CORPORATION (US) 2015-09-08 US disclosed
WO-2014144380-A1 BORON-CONTAINING DIACYLHYDRAZINES INTREXON CORPORATION (US) 2014-09-18 WO disclosed
US-20140274954-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION 2014-09-18 US disclosed
US-20140274954-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION 2014-09-18 US disclosed
US-20140274954-A1 Boron-Containing Diacylhydrazines INTREXON CORPORATION 2014-09-18 US disclosed
US-8623993-B2 Chemicals and the synthesizing methods thereof NATIONAL CHAIO TUNG UNIVERSITY (TW) 2014-01-07 US 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 (6 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-10464951-B2 Boron-containing diacylhydrazines CD22, BRDT, BCR KMT2A 1526/4885TSHR 236/4885MAPT 4167/4885
US-20150322092-A1 Boron-Containing Diacylhydrazines CD22, BRDT, BCR KMT2A 1526/4885TSHR 236/4885MAPT 4167/4885
US-10851119-B2 Boron-containing diacylhydrazines CD22, BRDT, BCR KMT2A 1526/4885TSHR 236/4885MAPT 4167/4885
US-20200157122-A1 BORON-CONTAINING DIACYLHYDRAZINES CD22, BRDT, BCR KMT2A 1526/4885TSHR 236/4885MAPT 4167/4885
US-20140274954-A1 Boron-Containing Diacylhydrazines CD22, BRDT, BCR KMT2A 1526/4885TSHR 236/4885MAPT 4167/4885
US-20180079759-A1 Boron-Containing Diacylhydrazines CD22, BRDT, BCR KMT2A 1526/4885TSHR 236/4885MAPT 4167/4885

“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.