SCHEMBL1764063

SCHEMBL1764063

C=C(Cc1ccc(Br)cc1)C(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
MAPK1 P28482 2/20 0.51
FABP7 O15540 1/20 0.47
FABP5 Q01469 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HPGD P15428 2/20 0.44
MEN1 O00255 1/20 0.44
TP53 P04637 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
MMP1 P03956 1/20 0.43
CNR2 P34972 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL6696083 0.91 ALDH1A1 (0.61) ALDH1A1L3MBTL1MAPK1KMT2ASMN1; SMN2
SCHEMBL1764151 0.86 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1TSHRKMT2A
SCHEMBL7644741 0.84 ALDH1A1 (0.54) ALDH1A1L3MBTL1MAPK1FABP7FABP5
Acrylic Acid SCHEMBL28230352 0.83 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1KMT2ASMN1; SMN2
SCHEMBL2658640 0.81 ALDH1A1 (0.79) ALDH1A1L3MBTL1MAPK1FABP7FABP5
SCHEMBL6925456 0.80 KMT2A (0.51) ALDH1A1L3MBTL1MAPK1KMT2ASMN1; SMN2
SCHEMBL7919473 0.79 ALDH1A1 (0.52) ALDH1A1L3MBTL1MAPK1TSHRKMT2A
SCHEMBL8979698 0.78 MAPT (0.47) ALDH1A1L3MBTL1MAPK1FABP7FABP5
SCHEMBL824071 0.77 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1TSHRKMT2A
SCHEMBL26128842 0.77 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1TSHRKMT2A

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
US-10131681-B2 Aminophosphinic derivatives that can be used in the treatment of pain PHARMALEADS (FR) 2018-11-20 US disclosed
US-20140161839-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN PHARMALEADS (FR) 2014-06-12 US disclosed
US-8703747-B2 Aminophosphinic derivatives that can be used in the treatment of pain PHARMALEADS (FR) 2014-04-22 US disclosed
US-20110124601-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN PHARMALEADS 2011-05-26 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 (3 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-20110124601-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN OPRM1, HRH3, HRH4 ALDH1A1 3363/4885L3MBTL1 3042/4885MAPK1 1817/4885
US-10131681-B2 Aminophosphinic derivatives that can be used in the treatment of pain OPRM1, HRH3, HRH4 ALDH1A1 3404/4885L3MBTL1 3112/4885MAPK1 1747/4885
US-20140161839-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN OPRM1, HRH3, HRH4 ALDH1A1 3404/4885L3MBTL1 3112/4885MAPK1 1747/4885

“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.