SCHEMBL16494147

SCHEMBL16494147

CCNC(=O)Oc1ccc2c(c1)CCN2

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.51
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CYP2C9 P11712 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP14 P50281 1/20 0.41
BCHE P06276 7/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL16494333 0.85 ACHE (0.49) ACHEDRD2DRD4ALDH1A1CYP2C9
SCHEMBL16494849 0.82 NPC1 (0.52) ACHEALDH1A1SMN1; SMN2
SCHEMBL16495073 0.80 HRH3 (0.42) ACHEDRD2DRD4ALDH1A1SMN1; SMN2
SCHEMBL16494376 0.80 TAAR1 (0.55) ACHESMN1; SMN2GAA
SCHEMBL28003267 0.80 DRD2 (0.50) ACHEDRD2DRD4ALDH1A1CYP2C9
SCHEMBL23217086 0.80 DRD2 (0.44) ACHEDRD2DRD4ALDH1A1CYP2C9
SCHEMBL29868521 0.78 MGLL (0.53) ACHE
SCHEMBL3172299 0.78 MGLL (0.53) ACHE
SCHEMBL29868757 0.78 MGLL (0.53) ACHE
SCHEMBL2401958 0.78 MGLL (0.53) ACHE

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-2394990-A1 INDOLINE DERIVATIVES Kyoto University (JP) 2011-12-14 EP disclosed
US-20110294850-A1 INDOLINE DERIVATIVES TOKYO INSTITUTE OF TECHNOLOGY (JP) 2011-12-01 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-20110294850-A1 INDOLINE DERIVATIVES BCHE, ACHE, INMT ACHE 2/4885DRD2 289/4885DRD4 239/4885

“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.