SCHEMBL24317730

SCHEMBL24317730

COC1(C(C)C)CCN(C(C)=O)C1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 5/20 0.38
CYP1A2 P05177 4/20 0.38
CYP2D6 P10635 5/20 0.37
ALDH1A1 P00352 4/20 0.37
USP2 O75604 2/20 0.35
CYP3A4 P08684 3/20 0.35
PIK3CD O00329 1/20 0.34
CYP2C19 P33261 2/20 0.34
MAPK1 P28482 1/20 0.34
EPHX2 P34913 1/20 0.34
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL4546627 0.90 CYP2D6 (0.41) CYP2C9CYP1A2CYP2D6ALDH1A1USP2
SCHEMBL12029857 0.89 PIK3CD (0.40) CYP2C9CYP1A2CYP2D6ALDH1A1USP2
SCHEMBL27010279 0.85 SMN1; SMN2 (0.41) CYP1A2PIK3CDEPHX2SMN1; SMN2TDP1
SCHEMBL23995696 0.85 CYP2D6 (0.40) CYP2C9CYP1A2CYP2D6ALDH1A1USP2
SCHEMBL26634753 0.81 CYP4F2 (0.35) CYP2C9CYP1A2CYP2D6ALDH1A1USP2
SCHEMBL24584223 0.76 CYP1A2 (0.36) CYP2C9CYP1A2CYP2D6ALDH1A1
SCHEMBL31094903 0.75 USP2 (0.47) CYP2C9CYP1A2CYP2D6ALDH1A1USP2
SCHEMBL27010334 0.74 EPHX2 (0.39) CYP2C9CYP1A2CYP2D6ALDH1A1USP2
SCHEMBL12259478 0.73 PIK3CD (0.38) CYP2C9CYP1A2CYP2D6ALDH1A1USP2
SCHEMBL8029490 0.72 DPP4 (0.45) CYP2C9CYP1A2ALDH1A1USP2CYP3A4

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 4 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-2023116902-A1 SOS1 INHIBITOR 北京望实智慧科技有限公司 2023-06-29 WO disclosed
WO-2023098825-A1 SOS1 INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 勤浩医药(苏州)有限公司 2023-06-08 WO 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 CYP2C9 2910/4885CYP1A2 2070/4885CYP2D6 3211/4885

“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.