SCHEMBL14401495

SCHEMBL14401495

COC(=O)[C@]1(c2ccccc2)C[C@H]1c1ccc2ccccc2c1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 7/20 0.50
SIGMAR1 Q99720 1/20 0.46
CHRM1 P11229 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
HTR2C P28335 1/20 0.42

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
SCHEMBL4338557 1.00 ADAM17 (0.50) ADAM17SIGMAR1CHRM1CTDSP1HTR2C
SCHEMBL13914852 1.00 ADAM17 (0.50) ADAM17SIGMAR1CHRM1CTDSP1HTR2C
SCHEMBL4338559 1.00 ADAM17 (0.50) ADAM17SIGMAR1CHRM1CTDSP1HTR2C
SCHEMBL15754696 0.84 CHRM1 (0.56) ADAM17SIGMAR1CHRM1HTR2C
SCHEMBL15754695 0.84 CHRM1 (0.56) ADAM17SIGMAR1CHRM1HTR2C
SCHEMBL28885376 0.81 SLC6A3 (0.44) ADAM17CTDSP1
SCHEMBL19335069 0.79 SIGMAR1 (0.43) ADAM17SIGMAR1CHRM1HTR2C
SCHEMBL20747777 0.74 ADAM17 (0.52) ADAM17SIGMAR1HTR2C
SCHEMBL13733533 0.72 ADAM17 (0.48) ADAM17SIGMAR1HTR2C
SCHEMBL13733793 0.72 ADAM17 (0.48) ADAM17SIGMAR1HTR2C

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-20070244201-A1 Cyclopropanes with central nervous system activity NIH-DEITR 2007-10-18 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-20070244201-A1 Cyclopropanes with central nervous system activity PMP22, CNR1, CNR2 ADAM17 3138/4885SIGMAR1 690/4885CHRM1 335/4885

“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.