SCHEMBL13849353

SCHEMBL13849353

CC(C)CN1CCC2(CCN(C)C2)CC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 15/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP3A4 P08684 5/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.38
TSHR P16473 3/20 0.38
USP2 O75604 3/20 0.38
CYP2C19 P33261 1/20 0.38
CYP2C9 P11712 1/20 0.38
PIK3CD O00329 1/20 0.37
CYP1A2 P05177 2/20 0.37

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
SCHEMBL22305208 0.90 CYP2D6 (0.53) CYP2D6SMN1; SMN2CYP3A4ALDH1A1MAPK1
SCHEMBL17285924 0.88 CYP2D6 (0.47) CYP2D6SMN1; SMN2CYP3A4ALDH1A1TSHR
SCHEMBL22477427 0.88 CYP2D6 (0.59) CYP2D6SMN1; SMN2CYP3A4ALDH1A1MAPK1
SCHEMBL18926698 0.85 CYP2D6 (0.56) CYP2D6SMN1; SMN2CYP3A4ALDH1A1TSHR
SCHEMBL18926689 0.83 CYP2D6 (0.68) CYP2D6SMN1; SMN2CYP3A4ALDH1A1MAPK1
SCHEMBL22477398 0.82 CYP2D6 (0.35) CYP2D6SMN1; SMN2CYP3A4TSHRUSP2
SCHEMBL24508755 0.82 CYP2D6 (0.49) CYP2D6SMN1; SMN2CYP3A4ALDH1A1TSHR
SCHEMBL18212474 0.81 CYP2D6 (0.52) CYP2D6SMN1; SMN2CYP3A4ALDH1A1TSHR
SCHEMBL18926690 0.81 CYP2D6 (0.56) CYP2D6SMN1; SMN2CYP3A4ALDH1A1MAPK1
SCHEMBL14706855 0.81 CYP2D6 (0.66) CYP2D6SMN1; SMN2CYP3A4ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230135894-A1 MK2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-04 US disclosed
US-11254696-B2 Dianilinopyrimidine compound for inhibiting kinase activity SHENZHEN TARGETRX, INC. (CN) 2022-02-22 US disclosed
US-20210087213-A1 DIANILINOPYRIMIDINE COMPOUND FOR INHIBITING KINASE ACTIVITY SHENZHEN TARGETRX, INC. (CN) 2021-03-25 US disclosed
EP-3715343-A1 DIPHENYLAMINOPYRIMIDINE COMPOUND FOR INHIBITING KINASE ACTIVITY Shenzhen TargetRx, Inc. (CN) 2020-09-30 EP disclosed
EP-2055705-A1 COMPOUND HAVING CYCLIC GROUP BOUND THERETO THROUGH SPIRO BINDING AND USE THEREOF Ono Pharmaceutical CO., LTD. (JP) 2009-05-06 EP 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 (3 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-20230135894-A1 MK2 DEGRADERS AND USES THEREOF MKNK2, MKRN3, DUS2 CYP2D6 474/4885SMN1; SMN2 3385/4885CYP3A4 649/4885
US-20210087213-A1 DIANILINOPYRIMIDINE COMPOUND FOR INHIBITING KINASE ACTIVITY ALK, BRAF, MUSK CYP2D6 627/4885SMN1; SMN2 641/4885CYP3A4 1557/4885
US-11254696-B2 Dianilinopyrimidine compound for inhibiting kinase activity ALK, BRAF, MUSK CYP2D6 669/4885SMN1; SMN2 693/4885CYP3A4 1802/4885

“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.