SCHEMBL23032154

SCHEMBL23032154

CC(C)(C)N1CCCC1c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL23032156 1.00 PRKCZ (0.40) PRKCZCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL26818027 0.95 PSEN1 (0.43) PRKCZCHRNA7
SCHEMBL26818028 0.93 PSEN1 (0.43) PRKCZCHRNA7
SCHEMBL23032157 0.84 CYP19A1 (0.42) PRKCZCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL23032119 0.84 CYP19A1 (0.42) PRKCZCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL23032120 0.84 CYP19A1 (0.42) PRKCZCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL14060569 0.83 CHRNB2 (0.40) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL29925230 0.83 CYP19A1 (0.41) PRKCZCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL13388673 0.82 CHRNB2 (0.59) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL22473392 0.82 CHRNB2 (0.59) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4

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-20220402915-A1 BCL-2 INHIBITORS BEONE MEDICINES I GMBH (CH) 2022-12-22 US disclosed
US-20210054007-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2021-02-25 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 (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-20220402915-A1 BCL-2 INHIBITORS BCL2, BCL2L1, BCL2L2 PRKCZ 630/4885CHRNB2 4503/4885CHRNB4 4860/4885
US-20210054007-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF TACR1, TACR2, GPBAR1 PRKCZ 3252/4885CHRNB2 688/4885CHRNB4 872/4885

“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.