SCHEMBL24065731

SCHEMBL24065731

CC(C)(C)c1ccc(CC(C)(C)c2cccc(N)c2)cc1C1CC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
CTSD P07339 1/20 0.32
BACE1 P56817 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
SCHEMBL26581120 0.74 NUDT1 (0.36) BACE1
SCHEMBL26427413 0.69
SCHEMBL18389453 0.68 TSHR (0.41) TSHRMAPK1CNR1CNR2
SCHEMBL28365405 0.68 MAOB (0.55) TSHRMAPK1
SCHEMBL19806050 0.67 ESR1 (0.33) CNR2
SCHEMBL12116527 0.66 CNR2 (0.50) TSHRMAPK1CNR1CNR2
SCHEMBL22761783 0.66 HTR2A (0.39) TSHRMAPK1
SCHEMBL19806085 0.66 KIF11 (0.35) TSHRMAPK1
SCHEMBL19841848 0.66 NR1H4 (0.38) MAPK1CNR1CNR2
SCHEMBL13650520 0.65 MAPK1 (0.52) TSHRMAPK1CNR1CNR2

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-20210371375-A1 hTERT MODULATORS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-12-02 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-20210371375-A1 hTERT MODULATORS AND METHODS OF USE TERT, TERF2, RB1 TSHR 264/4885MAPK1 2913/4885CNR1 3167/4885

“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.