SCHEMBL22686985

SCHEMBL22686985

COc1ccc(NC(=O)Cn2c(=O)[nH]c3ccccc3c2=O)cc1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.76
MAPK10 P53779 2/20 0.76
RXFP1 Q9HBX9 2/20 0.67
KMT2A Q03164 4/20 0.61
MEN1 O00255 2/20 0.61
MPO P05164 1/20 0.61
TSHR P16473 1/20 0.61
MAPK1 P28482 1/20 0.61
HSD17B10 Q99714 1/20 0.61
MAPT P10636 5/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
ALDH1A1 P00352 2/20 0.57
KDM4E B2RXH2 1/20 0.57
TP53 P04637 3/20 0.55
S1PR2 O95136 1/20 0.53
KAT2B Q92831 1/20 0.52
POLB P06746 1/20 0.52
ADORA3 P0DMS8 1/20 0.52

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
SCHEMBL22693556 0.83 LMNA (0.64) LMNAMAPK10KMT2AMEN1MPO
SCHEMBL31359012 0.83 GPR139 (0.60) LMNAMAPK10RXFP1TSHRMAPK1
SCHEMBL31359010 0.83 GPR139 (0.60) LMNAMAPK10RXFP1TSHRMAPK1
SCHEMBL32680072 0.79 CYP1A2 (0.61) LMNAMAPK10KMT2AMEN1MPO
SCHEMBL3312291 0.79 CYP1A2 (0.61) LMNAMAPK10KMT2AMEN1MPO
SCHEMBL7593290 0.77 MEN1 (0.77) LMNAMAPK10KMT2AMEN1TSHR
SCHEMBL31359079 0.77 MAPK10 (0.58) LMNAMAPK10KMT2AMEN1TSHR
SCHEMBL11985495 0.75 CYP1A2 (0.67) KMT2AMEN1MPOTSHRMAPK1
SCHEMBL3311524 0.73 ALDH1A1 (0.73) RXFP1KMT2AMEN1MPOTSHR
SCHEMBL31359061 0.72 GPR139 (0.56) RXFP1KMT2AMEN1MAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200369626-A1 COMPOSITIONS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR 2 (S1PR2) BINDING AGENTS AND USES THEREOF WASHINGTON UNIVERSITY (US) 2020-11-26 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 (1 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-20200369626-A1 COMPOSITIONS OF SPHINGOSINE-1-PHOSPHATE RECEPTOR 2 (S1PR2) BINDING AGENTS AND USES THEREOF S1PR2, S1PR1, S1PR3 LMNA 1789/4885MAPK10 3471/4885RXFP1 127/4885

“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.