SCHEMBL6972330

SCHEMBL6972330

CN(c1ccccc1)C1CCN(C(=O)c2ccco2)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.53
GPR55 Q9Y2T6 2/20 0.53
RAB9A P51151 2/20 0.50
NPC1 O15118 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
POLB P06746 3/20 0.48
HTT P42858 3/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
BRD4 O60885 1/20 0.45
GFER P55789 1/20 0.43
ALDH1A1 P00352 2/20 0.42
NR3C1 P04150 1/20 0.42
KCNA3 P22001 3/20 0.42
CHRM2 P08172 1/20 0.41
CHRM3 P20309 1/20 0.41
RBP4 P02753 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
SCHEMBL13776239 0.87 NPSR1 (0.56) NPSR1GPR55RAB9ANPC1TDP1
SCHEMBL6972312 0.86 NPSR1 (0.50) NPSR1GPR55RAB9ANPC1TDP1
SCHEMBL6971694 0.81 TDP1 (0.59) RAB9ANPC1TDP1HTTMAPT
SCHEMBL6970584 0.75 GFER (0.63) NPSR1RAB9ANPC1TDP1LMNA
SCHEMBL6973267 0.74 PDE4A (0.53) LMNAALDH1A1
SCHEMBL13776161 0.70 NPSR1 (0.73) NPSR1GPR55POLBHTTMAPT
SCHEMBL5394931 0.70 PTGDR2 (0.63) HTTMAPTLMNASMN1; SMN2MEN1
SCHEMBL13776242 0.69 NPSR1 (0.65) NPSR1GPR55POLBHTTMAPT
SCHEMBL4131812 0.69 NPSR1 (0.85) NPSR1GPR55POLBHTTMAPT
SCHEMBL4129393 0.69 NPSR1 (1.00) NPSR1GPR55POLBHTTMAPT

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-20030216398-A1 Soluble beta amyloid precursor protein secretion promoters TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2003-11-20 US disclosed
EP-1283055-A1 SOLUBLE BETA AMYLOID PRECURSOR PROTEIN SECRETION PROMOTERS Takeda Chemical Industries, Ltd. (JP) 2003-02-12 EP 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-20030216398-A1 Soluble beta amyloid precursor protein secretion promoters APP, BDNF, BACE1 NPSR1 541/4885GPR55 2325/4885RAB9A 3558/4885

“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.