SCHEMBL30767922

SCHEMBL30767922

C=CC(=O)N[C@@H]1Cc2ccccc2N(c2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 7/20 0.61
MTNR1A P48039 2/20 0.52
MTNR1B P49286 2/20 0.52
GSK3B P49841 1/20 0.41
TGM2 P21980 3/20 0.40
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.39
DRD2 P14416 2/20 0.36
DRD4 P21917 2/20 0.36

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
SCHEMBL30767969 1.00 TEAD1 (0.61) TEAD1MTNR1AMTNR1BGSK3BTGM2
SCHEMBL25332868 1.00 TEAD1 (0.61) TEAD1MTNR1AMTNR1BGSK3BTGM2
SCHEMBL30576458 1.00 TEAD1 (0.61) TEAD1MTNR1AMTNR1BGSK3BTGM2
SCHEMBL27034710 1.00 TEAD1 (0.61) TEAD1MTNR1AMTNR1BGSK3BTGM2
SCHEMBL30560824 0.89 TEAD1 (0.52) TEAD1MTNR1AMTNR1BGSK3BTGM2
SCHEMBL25378751 0.89 TEAD1 (0.52) TEAD1MTNR1AMTNR1BGSK3BTGM2
SCHEMBL31668903 0.89 TEAD1 (0.52) TEAD1MTNR1AMTNR1BGSK3BTGM2
SCHEMBL25378746 0.89 TEAD1 (0.52) TEAD1MTNR1AMTNR1BGSK3BTGM2
SCHEMBL27034481 0.89 TEAD1 (0.68) TEAD1MTNR1AMTNR1BSLC6A2SLC6A4
SCHEMBL25331531 0.88 MTNR1A (0.54) TEAD1MTNR1AMTNR1BSLC6A2SLC6A4

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-20240025856-A1 1,2,3,4-TETRAHYDROQUINOLINE DERIVATIVES AS INHIBITORS OF THE YAP/TAZ-TEAD ACTIVATION FOR TREATING CANCER CISTIM LEUVEN VZW (BE) 2024-01-25 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-20240025856-A1 1,2,3,4-TETRAHYDROQUINOLINE DERIVATIVES AS INHIBITORS OF THE YAP/TAZ-TEAD ACTIVATION FOR TREATING CANCER YAP1, TEAD2, TEAD1 TEAD1 3/4885MTNR1A 1460/4885MTNR1B 1468/4885

“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.