SCHEMBL12858869

SCHEMBL12858869

CC(C)N1CCN(C2CCCCCC2)CC1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.53
SIGMAR1 Q99720 2/20 0.46
CHRM2 P08172 7/20 0.44
CHRM1 P11229 7/20 0.44
TSHR P16473 3/20 0.44
TP53 P04637 1/20 0.44
PHGDH O43175 1/20 0.42
MGLL Q99685 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM3 P20309 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL8186259 1.00 HRH3 (0.53) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL10092689 0.98 HRH3 (0.50) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL12396793 0.93 HRH3 (0.46) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL24742908 0.91 HRH3 (0.47) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL22456382 0.91 HRH3 (0.49) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL10162384 0.90 HRH3 (0.46) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL10092700 0.88 HRH3 (0.41) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL10162381 0.87 HRH3 (0.43) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL6743387 0.86 SIGMAR1 (0.46) HRH3SIGMAR1CHRM2CHRM1TSHR
SCHEMBL14453902 0.86 HRH3 (0.41) HRH3TSHRTP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200190593-A1 SPLICEOSOME MUTATIONS AND USES THEREOF EISAI R&D MAN CO LTD (JP) 2020-06-18 US disclosed
US-20110028719-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS WARATAH PHARMACEUTICALS INC. (CA) 2011-02-03 US disclosed
WO-2007134449-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS WARATAH PHARMACEUTICALS INC. (CA) 2007-11-29 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 (2 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-20110028719-A1 SCREENING METHODS FOR AMYLOID BETA MODULATORS APP, BACE1, IAPP HRH3 2314/4885SIGMAR1 2967/4885CHRM2 1029/4885
US-20200190593-A1 SPLICEOSOME MUTATIONS AND USES THEREOF SF3B1, SF3B5, SF3A1 HRH3 3203/4885SIGMAR1 4126/4885CHRM2 4869/4885

“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.