SCHEMBL20206056

SCHEMBL20206056

CSN1CCC(C)(NC(=O)OCC(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 5/20 0.32
FSHR P23945 2/20 0.32
RAB9A P51151 1/20 0.31
GHSR Q92847 1/20 0.31
HSD11B1 P28845 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL20069155 0.84 RET (0.38) RETSMN1; SMN2TSHRFSHRRAB9A
SCHEMBL20147469 0.82 RET (0.38) RETSMN1; SMN2TSHRFSHRRAB9A
SCHEMBL20158494 0.77 RET (0.34) RETSMN1; SMN2KDM4E
SCHEMBL25261345 0.73 MGLL (0.48)
SCHEMBL20771226 0.71 HDAC1 (0.48) SMN1; SMN2RAB9AHDAC1HDAC2KDM4E
SCHEMBL20147484 0.69 ALDH1A1 (0.36) RETRAB9AKDM4EALDH1A1MAPT
SCHEMBL5196730 0.68 HDAC3 (0.46) SMN1; SMN2TSHRRAB9AHDAC1HDAC2
SCHEMBL18190864 0.67 SLC18A2 (0.40) SMN1; SMN2TSHRRAB9AGHSRKDM4E
SCHEMBL8592404 0.67 SMN1; SMN2 (0.43) SMN1; SMN2TSHRKDM4EALDH1A1MAPT
SCHEMBL20147917 0.67 ALDH1A1 (0.35) RETSMN1; SMN2RAB9AKDM4EALDH1A1

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-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-31 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-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 RET 1/4885SMN1; SMN2 646/4885TSHR 1441/4885

“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.