SCHEMBL3949148

SCHEMBL3949148

[CH2]N1CCN(C(=O)Nc2ccc(OC)cc2)CC1

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.88
SMN1; SMN2 Q16637 3/20 0.75
BLM P54132 1/20 0.71
KMT2A Q03164 3/20 0.70
CYP2D6 P10635 2/20 0.64
CYP1A2 P05177 1/20 0.64
TSHR P16473 1/20 0.64
TAS1R3 Q7RTX0 1/20 0.62
TAS1R1 Q7RTX1 1/20 0.62
TAS1R2 Q8TE23 1/20 0.62
FAAH O00519 2/20 0.60
LMNA P02545 1/20 0.60
CA12 O43570 2/20 0.60
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA9 Q16790 2/20 0.60
PTPN7 P35236 1/20 0.60
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
ALDH1A1 P00352 1/20 0.59

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
SCHEMBL28869329 0.94 MAPT (1.00) MAPTSMN1; SMN2BLMKMT2ACYP2D6
SCHEMBL20236897 0.88 MAPT (0.88) MAPTSMN1; SMN2BLMKMT2ACYP2D6
SCHEMBL3949152 0.88 MAPT (0.88) MAPTSMN1; SMN2BLMKMT2ACYP2D6
SCHEMBL8361624 0.87 SMN1; SMN2 (0.97) MAPTSMN1; SMN2BLMKMT2ACYP2D6
SCHEMBL4559572 0.87 SMN1; SMN2 (0.91) MAPTSMN1; SMN2BLMKMT2ACYP2D6
SCHEMBL5195426 0.86 SMN1; SMN2 (1.00) MAPTSMN1; SMN2BLMKMT2ACYP2D6
SCHEMBL13234920 0.85 MAPT (0.87) MAPTSMN1; SMN2BLMKMT2ALMNA
SCHEMBL20236190 0.84 MAPT (0.80) MAPTSMN1; SMN2BLMKMT2ACYP2D6
SCHEMBL20236800 0.84 MAPT (0.80) MAPTSMN1; SMN2BLMKMT2ACYP2D6
SCHEMBL5458965 0.83 MAPT (0.79) MAPTSMN1; SMN2BLMKMT2ACYP2D6

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
US-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 US disclosed
WO-2009022171-A1 PYRIDINYIIOXY PYRIDINES AS ALK5 INHIBITORS ASTRAZENECA AB (SE) 2009-02-19 WO 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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 MAPT 3204/4885SMN1; SMN2 4060/4885BLM 2096/4885

“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.