SCHEMBL16624022

SCHEMBL16624022

COc1cccc2c1CCN(C(C)C)C2

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 1/20 0.50
GABRA1 P14867 2/20 0.49
GABRG2 P18507 2/20 0.49
GABRB3 P28472 2/20 0.49
DRD2 P14416 4/20 0.47
DRD3 P35462 4/20 0.47
DRD1 P21728 1/20 0.47
DRD5 P21918 1/20 0.47
ACACB O00763 2/20 0.46
AKR1C3 P42330 1/20 0.44
DRD4 P21917 2/20 0.42
NOTUM Q6P988 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
SCHEMBL24702156 0.89 DRD2 (0.55) ABHD6GABRA1GABRG2GABRB3DRD2
SCHEMBL27010059 0.88 DRD2 (0.54) GABRA1GABRG2GABRB3DRD2DRD3
SCHEMBL27010070 0.85 ABHD6 (0.47) ABHD6GABRA1GABRG2GABRB3DRD2
SCHEMBL21216145 0.84 P2RY1 (0.44) ABHD6GABRA1GABRG2GABRB3ACACB
SCHEMBL23102221 0.82 ACACB (0.41) ABHD6GABRA1GABRG2GABRB3ACACB
SCHEMBL13068144 0.79 DRD2 (0.51) ABHD6DRD2DRD3DRD1DRD5
SCHEMBL22436028 0.79 NOTUM (0.38) GABRA1GABRG2GABRB3DRD3NOTUM
SCHEMBL11736393 0.79 DRD1 (0.67) ABHD6DRD2DRD3DRD1DRD5
SCHEMBL21216374 0.78 BCL2L1 (0.46) GABRA1GABRG2GABRB3DRD2DRD3
SCHEMBL21361602 0.78 ADRA2A (0.57) DRD2ACACBAKR1C3NOTUM

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 US disclosed
EP-3765447-B1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2023-07-12 EP disclosed
US-20220402891-A1 TRIAZACYCLODODECANSULFONAMIDE (TCD)-BASED PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-12-22 US disclosed
EP-3746435-B1 SUBSTITUTED QUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER (US) 2022-08-03 EP disclosed
US-20160237071-A1 T-TYPE CALCIUM CHANNEL INHIBITOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-08-18 US disclosed
EP-3053917-A1 T-TYPE CALCIUM CHANNEL BLOCKER Nissan Chemical Industries, Ltd. (JP) 2016-08-10 EP disclosed
WO-2015050212-A1 T-TYPE CALCIUM CHANNEL BLOCKER 日産化学工業株式会社 2015-04-09 WO 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 (3 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-20160237071-A1 T-TYPE CALCIUM CHANNEL INHIBITOR CACNA1I, CACNA1G, CACNA1H ABHD6 4475/4885GABRA1 1679/4885GABRG2 2370/4885
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY NFATC1, CTSS, MMP12 ABHD6 3261/4885GABRA1 3768/4885GABRG2 3571/4885
US-20220402891-A1 TRIAZACYCLODODECANSULFONAMIDE (TCD)-BASED PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G ABHD6 53/4885GABRA1 3646/4885GABRG2 3589/4885

“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.