SCHEMBL16035544

SCHEMBL16035544

C=CCc1ccc(C(=O)O)c(C)c1O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
MAPK1 P28482 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 2/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38
ELANE P08246 1/20 0.37
GRM1 Q13255 1/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SELL P14151 1/20 0.36
SELP P16109 1/20 0.36

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
SCHEMBL28896783 0.84 SELL (0.48) GABRA1GABRB2MAPK1MEN1KMT2A
SCHEMBL20145965 0.84 HMGB1 (0.37) SLC22A6SLC22A8GRM1KDM4EHSD17B10
SCHEMBL28844937 0.83 KDM4E (0.37) GABRA1GABRB2MAPK1MEN1KMT2A
SCHEMBL8895803 0.83 KDM4E (0.43) MAPK1MEN1KMT2AGAASLC22A6
SCHEMBL2428559 0.83 MAPK1 (0.44) GABRA1GABRB2MAPK1MEN1KMT2A
SCHEMBL299374 0.78 SELL (0.41) GABRA1GABRB2GAAKDM4EHSD17B10
SCHEMBL8816524 0.78 SELL (0.41) GABRA1GABRB2MAPK1KDM4EHSD17B10
SCHEMBL8772614 0.78 SLC22A6 (0.44) GABRA1GABRB2MEN1KMT2AGAA
SCHEMBL7369721 0.78 MRGPRX4 (0.45) GABRA1GABRB2KMT2AKDM4EHSD17B10
SCHEMBL16035208 0.77 KDM4E (0.44) MAPK1MEN1KMT2AELANEKDM4E

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
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-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-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

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 GABRA1 2095/4885GABRB2 1930/4885MAPK1 1876/4885
US-20150322092-A1 Boron-Containing Diacylhydrazines CD22, BRDT, BCR GABRA1 2095/4885GABRB2 1930/4885MAPK1 1876/4885
US-10851119-B2 Boron-containing diacylhydrazines CD22, BRDT, BCR GABRA1 2095/4885GABRB2 1930/4885MAPK1 1876/4885
US-20200157122-A1 BORON-CONTAINING DIACYLHYDRAZINES CD22, BRDT, BCR GABRA1 2095/4885GABRB2 1930/4885MAPK1 1876/4885
US-20140274954-A1 Boron-Containing Diacylhydrazines CD22, BRDT, BCR GABRA1 2095/4885GABRB2 1930/4885MAPK1 1876/4885
US-20180079759-A1 Boron-Containing Diacylhydrazines CD22, BRDT, BCR GABRA1 2095/4885GABRB2 1930/4885MAPK1 1876/4885

“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.