SCHEMBL1764151

SCHEMBL1764151

C=C(Cc1ccc(-c2ccccc2)cc1)C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
LMNA P02545 2/20 0.51
ABCC4 O15439 1/20 0.51
GAA P10253 1/20 0.51
TSHR P16473 1/20 0.51
PTGS1 P23219 1/20 0.51
HTT P42858 1/20 0.51
ENPP2 Q13822 3/20 0.50
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 2/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
EPHX1 P07099 1/20 0.45
MGLL Q99685 1/20 0.44
MEN1 O00255 1/20 0.44
IDO1 P14902 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
SCHEMBL6696083 0.92 ALDH1A1 (0.61) ALDH1A1MAPK1L3MBTL1LMNAHTT
SCHEMBL1764063 0.86 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1LMNATSHR
Acrylic Acid SCHEMBL28230352 0.84 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1LMNAHTT
SCHEMBL7367996 0.84 LMNA (0.51) ALDH1A1L3MBTL1LMNAABCC4GAA
SCHEMBL20022965 0.84 ALDH1A1 (0.56) ALDH1A1MAPK1L3MBTL1LMNAABCC4
SCHEMBL28835498 0.81 LMNA (0.55) ALDH1A1LMNAABCC4GAATSHR
SCHEMBL18499931 0.81 RAB9A (0.50) ALDH1A1MAPK1L3MBTL1LMNAABCC4
SCHEMBL20053205 0.81 NPC1 (0.50) ALDH1A1MAPK1L3MBTL1LMNAABCC4
SCHEMBL2432768 0.81 ALDH1A1 (0.53) ALDH1A1LMNAABCC4GAATSHR
SCHEMBL824071 0.78 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1LMNATSHR

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 3363/4885MAPK1 1817/4885L3MBTL1 3042/4885
US-10131681-B2 Aminophosphinic derivatives that can be used in the treatment of pain OPRM1, HRH3, HRH4 ALDH1A1 3404/4885MAPK1 1747/4885L3MBTL1 3112/4885
US-20140161839-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN OPRM1, HRH3, HRH4 ALDH1A1 3404/4885MAPK1 1747/4885L3MBTL1 3112/4885

“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.