SCHEMBL26101079

SCHEMBL26101079

CC(C)(C)C1CCN(C(=O)c2ccc(C#N)cc2Br)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F11 P03951 2/20 0.45
L3MBTL3 Q96JM7 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MBTD1 Q05BQ5 1/20 0.44
NR1I2 O75469 2/20 0.43
CACNA1B Q00975 2/20 0.43
POLB P06746 1/20 0.41
FASN P49327 4/20 0.40
RORC P51449 3/20 0.40
KDM1A O60341 3/20 0.39
PDK2 Q15119 2/20 0.39
PDK1 Q15118 1/20 0.39
PDK3 Q15120 1/20 0.39
PDK4 Q16654 1/20 0.39
MGLL Q99685 1/20 0.38

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
SCHEMBL26104742 0.88 L3MBTL3 (0.44) L3MBTL3L3MBTL1MBTD1NR1I2CACNA1B
SCHEMBL30430483 0.88 L3MBTL3 (0.44) L3MBTL3L3MBTL1MBTD1NR1I2CACNA1B
SCHEMBL26103351 0.86 L3MBTL3 (0.47) L3MBTL3L3MBTL1MBTD1POLBFASN
SCHEMBL26103330 0.83 RORC (0.47) L3MBTL3L3MBTL1MBTD1POLBFASN
SCHEMBL26100203 0.80 KDM1A (0.43) L3MBTL3L3MBTL1MBTD1POLBFASN
SCHEMBL30430028 0.80 MBTD1 (0.42) L3MBTL3L3MBTL1MBTD1NR1I2CACNA1B
SCHEMBL26100540 0.80 MBTD1 (0.42) L3MBTL3L3MBTL1MBTD1NR1I2CACNA1B
SCHEMBL23981996 0.77 SMN1; SMN2 (0.46)
SCHEMBL26102750 0.77 USP2 (0.39) L3MBTL3L3MBTL1MBTD1FASN
SCHEMBL30396674 0.76 SLC6A9 (0.40) L3MBTL3L3MBTL1MBTD1FASN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250333405-A1 ANTAGONISTS OF GPR39 PROTEIN VASOCARDEA INC (US) 2025-10-30 US disclosed
EP-4423090-A2 ANTAGONISTS OF GPR39 PROTEIN Vasocardea, Inc. (US) 2024-09-04 EP disclosed
WO-2023076219-A2 ANTAGONISTS OF GPR39 PROTEIN VASOCARDEA, INC. (US) 2023-05-04 WO disclosed
WO-2023076219-A2 ANTAGONISTS OF GPR39 PROTEIN VASOCARDEA, INC. (US) 2023-05-04 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 (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-20250333405-A1 ANTAGONISTS OF GPR39 PROTEIN GPR39, GPR139, GPR119 F11 4525/4885L3MBTL3 3798/4885L3MBTL1 2803/4885

“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.