SCHEMBL13041576

SCHEMBL13041576

CB(O)N1CCCC(C(=O)Nc2ccccc2Br)C1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
EPHX2 P34913 1/20 0.48
POLB P06746 1/20 0.48
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 2/20 0.44
HSD17B10 Q99714 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
SCHEMBL13845844 0.80 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL3739365 0.75 PARP1 (0.53) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL28669892 0.74 NPC1 (0.63) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL9965417 0.72 EPHX2 (0.57) MAPTKMT2ASMN1; SMN2EPHX2POLB
SCHEMBL13041579 0.70 PKM (0.44) KMT2AMEN1ALDH1A1SMN1; SMN2POLB
SCHEMBL4104057 0.70 EPHX2 (0.55) MAPTSMN1; SMN2EPHX2POLBNPC1
SCHEMBL17187657 0.70 EPHX2 (0.49) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL13003435 0.70 TSHR (0.65) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL18138936 0.70 POLB (0.51) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL13041440 0.69 EPHX2 (0.54) MAPTKMT2ASMN1; SMN2EPHX2POLB

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-20100280049-A1 ANTAGONISTS OF PGD2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-11-04 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-20100280049-A1 ANTAGONISTS OF PGD2 RECEPTORS PTGDR2, PTGDR, LTB4R2 MAPT 4781/4885KMT2A 4361/4885MEN1 4821/4885

“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.