SCHEMBL21908489

SCHEMBL21908489

CN1C(C)(C)CC(Cc2ccc(CC3CC(C)(C)N(C)C3(C)C)cc2)C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
CAPN1 P07384 1/20 0.30

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
SCHEMBL21908490 0.95 HRH3 (0.33)
SCHEMBL21102928 0.87 ALDH1A1 (0.34) GAAKDM4EALDH1A1
SCHEMBL21102929 0.84 ALDH1A1 (0.32) GAAKDM4EALDH1A1
SCHEMBL11526738 0.76 KDM4E (0.34) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL11528763 0.72 CARM1 (0.34) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL15003162 0.71
SCHEMBL9358391 0.71 TRPA1 (0.40) GAA
SCHEMBL19764500 0.69 KDM4E (0.31) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL17541209 0.69 DHFR (0.36)
SCHEMBL9358209 0.68 LMNA (0.38) KDM4EMEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10633590-B2 Liquid crystal composition and liquid crystal display device including the same DIC CORPORATION (JP) 2020-04-28 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-10633590-B2 Liquid crystal composition and liquid crystal display device including the same LASP1, UACA, CCDC22 GAA 4678/4885KDM4E 4273/4885MEN1 3452/4885

“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.