SCHEMBL20009059

SCHEMBL20009059

CC(C)N1CC2CCC(C1)N2C(=O)N(C)C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
HRH3 Q9Y5N1 2/20 0.31
GAA P10253 1/20 0.31
CYP2D6 P10635 1/20 0.31
KCNH2 Q12809 1/20 0.31
AGTR2 P50052 3/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL24444263 0.89 MEN1 (0.31) MEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL20008986 0.80 SMN1; SMN2 (0.37) GRM5SMN1; SMN2HRH3CYP2D6KCNH2
SCHEMBL21722669 0.80 HRH3 (0.33) HRH3CYP2D6KCNH2MAPT
SCHEMBL18375130 0.80 SMN1; SMN2 (0.37) GRM5SMN1; SMN2HRH3CYP2D6KCNH2
SCHEMBL7839622 0.79 TLR9 (0.32) HSD17B10HRH3CYP2D6KCNH2MAPT
SCHEMBL15196701 0.78 ALDH1A1 (0.42) HRH3CYP2D6KCNH2
SCHEMBL26203667 0.77 ALDH1A1 (0.32) HRH3CYP2D6KCNH2
SCHEMBL7851975 0.77 HRH3 (0.41) HRH3GAAMAPT
SCHEMBL20682344 0.76 TSHR (0.38) GRM5KCNH2MAPT
SCHEMBL20009056 0.76 HRH3 (0.37) HRH3CYP2D6KCNH2AGTR2

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-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-03-29 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-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF SMARCC1, SMARCC2, SMARCA4 GRM5 1607/4885MEN1 1824/4885KMT2A 489/4885

“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.