SCHEMBL21730189

SCHEMBL21730189

CC(C)Cc1ccc2c(n1)CCN2C(C)C

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 10/20 0.36
NOTUM Q6P988 1/20 0.33
TSHR P16473 1/20 0.32
MAPK1 P28482 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
SCHEMBL24221619 0.83 GRM5 (0.32) GRM5
SCHEMBL22993267 0.74 CYP2C19 (0.43) TSHR
SCHEMBL21730188 0.73 MAPT (0.36) GRM5
SCHEMBL24253486 0.71 MAOA (0.40)
SCHEMBL22723932 0.70 CYP3A4 (0.37) GRM5TSHR
SCHEMBL24783744 0.69 MAPK8 (0.41) NOTUM
SCHEMBL19864622 0.68 JAK2 (0.34) GRM5NOTUMTSHRMAPK1
SCHEMBL22694924 0.68 GRM5 (0.30) GRM5
SCHEMBL22387665 0.67 ADRA2A (0.37) TSHRMAPK1
SCHEMBL11639939 0.67 ADRA2A (0.40) TSHRMAPK1

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-20220396631-A1 TRISPECIFIC BINDING MOLECULES AGAINST BCMA AND USES THEREOF NOVARTIS AG (CH) 2022-12-15 US disclosed
US-20200055948-A1 CELLS EXPRESSING A BCMA-TARGETING CHIMERIC ANTIGEN RECEPTOR, AND COMBINATION THERAPY WITH A GAMMA SECRETASE INHIBITOR NOVARTIS AG (CH) 2020-02-20 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 (2 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-20200055948-A1 CELLS EXPRESSING A BCMA-TARGETING CHIMERIC ANTIGEN RECEPTOR, AND COMBINATION THERAPY WITH A GAMMA SECRETASE INHIBITOR BACE1, BACE2, GSAP GRM5 1380/4885NOTUM 1209/4885TSHR 3220/4885
US-20220396631-A1 TRISPECIFIC BINDING MOLECULES AGAINST BCMA AND USES THEREOF CD2, CD2BP2, CD22 GRM5 1995/4885NOTUM 2800/4885TSHR 387/4885

“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.