SCHEMBL2790841

SCHEMBL2790841

CON(C(=O)c1ccccc1)[C@@H](C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
PLA2G1B P04054 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ATG4B Q9Y4P1 1/20 0.44
TSHR P16473 2/20 0.42
PGR P06401 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
HTR2A P28223 1/20 0.42
HRH1 P35367 1/20 0.42
KCNH2 Q12809 1/20 0.42
POLB P06746 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
MLYCD O95822 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL2792270 1.00 KMT2A (0.44) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL2791618 1.00 KMT2A (0.44) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL8396776 0.85 TSHR (0.45) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL25890673 0.79 POLB (0.41) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL2794043 0.78 HPGD (0.39) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL2794802 0.78 HPGD (0.39) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL12984864 0.77 HPGD (0.38) KMT2AMEN1TSHRPOLBHPGD
SCHEMBL28307954 0.76 PGR (0.46) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL11238917 0.76 PGR (0.46) KMT2AMEN1PLA2G1BHTTNPSR1
SCHEMBL11238921 0.76 PGR (0.46) KMT2AMEN1PLA2G1BHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110065794-A1 Wrinkle-preventing and improving composition SHISEIDO COMPANY, LTD. (JP) 2011-03-17 US disclosed
US-20100168468-A1 WRINKLE-PREVENTING AND IMPROVING COMPOSITION KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-07-01 US disclosed
EP-1908454-A1 WRINKLE-PREVENTIVE/AMELIORATING AGENT SHISEIDO COMPANY, LTD. (JP) 2008-04-09 EP 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 (2 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-20100168468-A1 WRINKLE-PREVENTING AND IMPROVING COMPOSITION COL1A1, COL2A1, COL14A1 KMT2A 2892/4885MEN1 3089/4885PLA2G1B 2218/4885
US-20110065794-A1 Wrinkle-preventing and improving composition COL1A1, COL2A1, COL14A1 KMT2A 2892/4885MEN1 3089/4885PLA2G1B 2218/4885

“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.