SCHEMBL16889137

SCHEMBL16889137

CC1CCC(C(N)=O)CC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 2/20 0.33
EPHX1 P07099 1/20 0.33
APLNR P35414 1/20 0.32
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
CYP2D6 P10635 1/20 0.31
GAA P10253 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
SCHEMBL13647403 0.81 ALOX15 (0.33) MAPTAPLNR
SCHEMBL23863870 0.76 CHRNB2 (0.36) APLNR
SCHEMBL16885302 0.75 EPHX1 (0.33) SMN1; SMN2EPHX1
SCHEMBL14446943 0.70 APLNR (0.44) SMN1; SMN2MAPTEPHX1APLNRKDM4E
Cyclopropanecarboxylic Acid Amide SCHEMBL6927157 0.68 SMN1; SMN2 (0.50) SMN1; SMN2MAPTEPHX1KDM4EKMT2A
SCHEMBL28418543 0.68 SMN1; SMN2 (0.50) SMN1; SMN2MAPTEPHX1KDM4EKMT2A
Cyclopropanecarboxylic Acid Amide SCHEMBL5661 0.68
SCHEMBL9797557 0.68 SMN1; SMN2 (0.50) SMN1; SMN2MAPTEPHX1KDM4EKMT2A
SCHEMBL383436 0.68 SMN1; SMN2 (0.50) SMN1; SMN2MAPTEPHX1KDM4EKMT2A
SCHEMBL13332956 0.68 SMN1; SMN2 (0.50) SMN1; SMN2MAPTEPHX1KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242984-B2 Pyrazolyl derivatives as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2016-01-26 US disclosed
US-20150191461-A1 PYRAZOLYL DERIVATIVES AS SYK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-07-09 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-20150191461-A1 PYRAZOLYL DERIVATIVES AS SYK INHIBITORS SYK, BTK, LCK SMN1; SMN2 4721/4885MAPT 4283/4885EPHX1 1507/4885

“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.