SCHEMBL13232149

SCHEMBL13232149

CC1(C)C(C)(C)C12CCC(C(N)=O)CC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.37
TDP1 Q9NUW8 3/20 0.35
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34
CYP2D6 P10635 1/20 0.34
GRM2 Q14416 2/20 0.33
GRM3 Q14832 2/20 0.33
GRM4 Q14833 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP2C19 P33261 1/20 0.33
GRM8 O00222 1/20 0.33
GRM6 O15303 1/20 0.33
LMNA P02545 1/20 0.33
GRM5 P41594 1/20 0.33
MTOR P42345 1/20 0.33

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
SCHEMBL2232346 0.83 SMN1; SMN2 (0.43) SMN1; SMN2GAATDP1KMT2AKDM4E
SCHEMBL16841477 0.81 SMN1; SMN2 (0.42) SMN1; SMN2GAATDP1KMT2AKDM4E
SCHEMBL16841467 0.81 SMN1; SMN2 (0.42) SMN1; SMN2GAATDP1KMT2AKDM4E
SCHEMBL19315873 0.81 SMN1; SMN2 (0.42) SMN1; SMN2GAATDP1KMT2AKDM4E
SCHEMBL19386548 0.79 SMN1; SMN2 (0.41) SMN1; SMN2GAATDP1KMT2AKDM4E
SCHEMBL28243791 0.79 SMN1; SMN2 (0.41) SMN1; SMN2GAATDP1KMT2AKDM4E
SCHEMBL19919700 0.77 FFAR3 (0.54) SMN1; SMN2GAATDP1GRM2GRM3
SCHEMBL25001002 0.76 SMN1; SMN2 (0.38) SMN1; SMN2GAATDP1KMT2AKDM4E
SCHEMBL19807106 0.76 KDM4E (0.39) SMN1; SMN2GAATDP1KMT2AKDM4E
SCHEMBL16552279 0.76 SMN1; SMN2 (0.47) SMN1; SMN2GAATDP1KMT2AKDM4E

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-20100166819-A1 Transforming Growth Factor Modulators BIOGEN IDEC MA INC. A CORPORATION 2010-07-01 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-20100166819-A1 Transforming Growth Factor Modulators ACVR1, TGFBR1, ACVRL1 SMN1; SMN2 4638/4885GAA 3308/4885TDP1 4499/4885

“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.