SCHEMBL21165025

SCHEMBL21165025

Cc1cc(C(=O)CNC2CCCCC2)c(C)n1-c1ccc(I)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.55
HPGD P15428 6/20 0.55
NPC1 O15118 6/20 0.55
RAB9A P51151 6/20 0.55
ALDH1A1 P00352 3/20 0.55
CNR2 P34972 1/20 0.54
KDM4E B2RXH2 3/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
USP14 P54578 9/20 0.50
USP7 Q93009 3/20 0.50
USP5 P45974 2/20 0.50
HTT P42858 2/20 0.49
TP53 P04637 1/20 0.48
LMNA P02545 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
SCHEMBL19501354 0.91 SMN1; SMN2 (0.63) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL23559409 0.89 USP14 (0.65) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL17949745 0.89 USP14 (0.65) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL6921750 0.89 SMN1; SMN2 (0.55) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL19749203 0.87 USP14 (0.50) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL23524575 0.82 SMN1; SMN2 (0.63) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL19749200 0.80 USP14 (0.49) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL6922448 0.79 SMN1; SMN2 (0.81) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL23524513 0.79 SMN1; SMN2 (0.58) SMN1; SMN2HPGDNPC1RAB9AALDH1A1
SCHEMBL19501866 0.78 SMN1; SMN2 (0.53) SMN1; SMN2HPGDNPC1RAB9AALDH1A1

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-10351568-B2 Compositions and methods for enhancing proteasome activity PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-07-16 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-10351568-B2 Compositions and methods for enhancing proteasome activity PSMG3, PSME3, PSMB11 SMN1; SMN2 307/4885HPGD 4170/4885NPC1 2643/4885

“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.