SCHEMBL7123963

SCHEMBL7123963

CN1CCC(C(C)(C)c2ccc(NC(=O)c3cccnc3)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.57
NPC1 O15118 6/20 0.57
SMN1; SMN2 Q16637 6/20 0.57
MAPT P10636 3/20 0.57
GAA P10253 2/20 0.57
NAMPT P43490 4/20 0.56
TP53 P04637 3/20 0.53
GFER P55789 2/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.52
HIF1A Q16665 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
ROCK2 O75116 1/20 0.51
ROCK1 Q13464 1/20 0.51
KCNK3 O14649 1/20 0.50
MEN1 O00255 1/20 0.48
TSHR P16473 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL28683089 0.82 SMN1; SMN2 (0.59) RAB9ANPC1SMN1; SMN2MAPTGAA
SCHEMBL3141747 0.81 KDR (0.47) RAB9AMAPTGAANAMPTALDH1A1
SCHEMBL447100 0.79 ALDH1A1 (0.44) NAMPTALDH1A1MEN1KMT2A
SCHEMBL13167592 0.78 NAMPT (0.82) RAB9ANPC1SMN1; SMN2MAPTGAA
SCHEMBL14395102 0.77 HTR1F (0.69) RAB9ANPC1SMN1; SMN2MAPTGAA
SCHEMBL5626692 0.76 PTGS1 (0.55) RAB9ANPC1SMN1; SMN2NAMPTMEN1
SCHEMBL28694761 0.75 SMN1; SMN2 (0.53) RAB9ANPC1SMN1; SMN2MAPTGAA
SCHEMBL10260121 0.74 TSHR (0.64) SMN1; SMN2ALDH1A1KCNK3MEN1TSHR
SCHEMBL4498324 0.74 KCNK3 (0.54) RAB9ANPC1SMN1; SMN2MAPTGAA
SCHEMBL447011 0.74 KDR (0.66)

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-20030125339-A1 Substituted alkylamine derivatives and methods of use AMGEN INC. 2003-07-03 US claimed

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-20030125339-A1 Substituted alkylamine derivatives and methods of use AADAC, NAT1, PIGO RAB9A 3627/4885NPC1 650/4885SMN1; SMN2 2090/4885

“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.