SCHEMBL222991

SCHEMBL222991

CCOC(=O)c1ccc2c(c1)[C@@H](OC(=O)c1ccccc1)C[C@H](C)N2C(C)=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 1/20 0.56
LMNA P02545 2/20 0.56
NPSR1 Q6W5P4 4/20 0.54
MEN1 O00255 1/20 0.54
MAPT P10636 1/20 0.54
KMT2A Q03164 1/20 0.54
BRD4 O60885 6/20 0.48
BRD2 P25440 5/20 0.48
BRD3 Q15059 5/20 0.48
PTGDR2 Q9Y5Y4 3/20 0.44
TP53 P04637 1/20 0.41
PRMT1 Q99873 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL225279 0.82 BRD4 (0.46) SMN1; SMN2KMT2ABRD4BRD2BRD3
SCHEMBL224343 0.82 BRD4 (0.46) SMN1; SMN2KMT2ABRD4BRD2BRD3
SCHEMBL224530 0.80 BRD4 (0.47) SMN1; SMN2TSHRLMNANPSR1MEN1
SCHEMBL225382 0.80 BRD4 (0.45) SMN1; SMN2TSHRLMNANPSR1MEN1
SCHEMBL223664 0.80 BRD4 (0.47) SMN1; SMN2TSHRLMNANPSR1MEN1
SCHEMBL222902 0.80 LMNA (0.44) SMN1; SMN2TSHRLMNANPSR1MEN1
SCHEMBL222992 0.80 LMNA (0.59) SMN1; SMN2TSHRLMNANPSR1MEN1
SCHEMBL5838210 0.78 BRD4 (0.64) BRD4BRD2BRD3
SCHEMBL5838204 0.78 BRD4 (0.64) BRD4BRD2BRD3
SCHEMBL5838215 0.78 BRD4 (0.64) BRD4BRD2BRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415764-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR ANEMIA COMPRISING TETRAHYDROQUINOLINE COMPOUND AS ACTIVE INGREDIENT Kowa Company, Ltd. (JP) 2012-02-08 EP disclosed
US-20120004197-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR ANEMIA COMPRISING TETRAHYDROQUINOLINE COMPOUND AS ACTIVE INGREDIENT KOWA COMPANY, LTD. (JP) 2012-01-05 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-20120004197-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR ANEMIA COMPRISING TETRAHYDROQUINOLINE COMPOUND AS ACTIVE INGREDIENT EPOR, HBG1, HBG2 SMN1; SMN2 2091/4885TSHR 806/4885LMNA 4334/4885

“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.