SCHEMBL24317731

SCHEMBL24317731

CC(=O)N1CCC(C)(C(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
EPHX2 P34913 2/20 0.38
CYP3A4 P08684 4/20 0.37
PIK3CD O00329 1/20 0.37
CYP2C19 P33261 3/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 1/20 0.37
CYP1A2 P05177 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP2C9 P11712 3/20 0.35
CYP2D6 P10635 3/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
USP2 O75604 2/20 0.34
TSHR P16473 2/20 0.34
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
MEN1 O00255 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
SCHEMBL12921202 1.00 SMN1; SMN2 (0.39) SMN1; SMN2EPHX2CYP3A4PIK3CDCYP2C19
SCHEMBL17172988 1.00 SMN1; SMN2 (0.39) SMN1; SMN2EPHX2CYP3A4PIK3CDCYP2C19
SCHEMBL12921229 0.89 CYP2D6 (0.40) SMN1; SMN2EPHX2CYP3A4PIK3CDCYP2C19
SCHEMBL7897247 0.88 PIK3CD (0.44) SMN1; SMN2EPHX2CYP3A4PIK3CDCYP2C19
SCHEMBL9882851 0.83 SMN1; SMN2 (0.50) SMN1; SMN2EPHX2CYP3A4PIK3CDCYP2C19
SCHEMBL26053285 0.82 SMN1; SMN2 (0.38) SMN1; SMN2EPHX2CYP3A4PIK3CDCYP2C19
SCHEMBL17172991 0.82 CHRNB2 (0.36) PIK3CDALDH1A1CYP1A2CYP2C9
SCHEMBL25708741 0.82 SMN1; SMN2 (0.38) SMN1; SMN2EPHX2CYP3A4PIK3CDCYP2C19
SCHEMBL17172992 0.82 CHRNB2 (0.36) PIK3CDALDH1A1CYP1A2CYP2C9
SCHEMBL17173000 0.81 DPP4 (0.33)

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-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 US disclosed
WO-2022081927-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C4 THERAPEUTICS, INC. (US) 2022-04-21 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 (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-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY NFATC1, CTSS, MMP12 SMN1; SMN2 524/4885EPHX2 2867/4885CYP3A4 2566/4885

“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.