SCHEMBL13148271

SCHEMBL13148271

CC1(C)CC(N2CN3C(=O)N4CN(C5CC(C)(C)CC(C)(C)C5)CN5C(=O)N(C2)C3C45)CC(C)(C)C1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.38
CNR2 P34972 10/20 0.36
CNR1 P21554 4/20 0.33
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL20200267 0.91 MAPK1 (0.52) MAPK1CNR2LMNAKDM4EALDH1A1
SCHEMBL10156047 0.80 MAPK1 (0.37) MAPK1LMNA
SCHEMBL310962 0.80 MAPK1 (0.59) MAPK1LMNAKDM4EALDH1A1
SCHEMBL13290098 0.73 MAPK1 (0.51) MAPK1LMNAKDM4E
SCHEMBL13871885 0.72 MAPK1 (0.32) MAPK1
SCHEMBL12723445 0.72 MAPK1 (0.32) MAPK1
SCHEMBL14404588 0.71 MAPK1 (0.54) MAPK1LMNAKDM4E
SCHEMBL14189666 0.67 CNR2 (0.42) CNR2CNR1LMNAKDM4EATM
SCHEMBL13527759 0.67 ADRA2C (0.35)
SCHEMBL13899614 0.67 ADRA2C (0.35)

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-20100234494-A1 Reversibly thermochromic compositions CIBA CORPORATION 2010-09-16 US disclosed
US-20100048774-A1 STABILIZER MIXTURES GUGUMUS FRANCOIS 2010-02-25 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-20100234494-A1 Reversibly thermochromic compositions CRY1, REL, CRY2 MAPK1 1405/4885CNR2 212/4885CNR1 234/4885

“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.