SCHEMBL30828281

SCHEMBL30828281

COC1CCN(C(=O)N2CCC(=C(C#N)c3cccc(Cl)c3)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.42
PDE4B Q07343 1/20 0.41
HSD11B1 P28845 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GRM5 P41594 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.37

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
SCHEMBL29205175 1.00 MGLL (0.42) MGLLPDE4BHSD11B1MEN1KMT2A
SCHEMBL30056286 0.89 MGLL (0.40) MGLLPDE4BHSD11B1MEN1KMT2A
SCHEMBL30055420 0.89 MGLL (0.40) MGLLPDE4BHSD11B1MEN1KMT2A
SCHEMBL27166097 0.89 MGLL (0.40) MGLLPDE4BHSD11B1MEN1KMT2A
SCHEMBL29205190 0.89 MGLL (0.40) MGLLPDE4BHSD11B1MEN1KMT2A
SCHEMBL27166027 0.87 MGLL (0.45) MGLLHSD11B1MEN1KMT2ANPSR1
SCHEMBL30055604 0.87 MGLL (0.45) MGLLHSD11B1MEN1KMT2ANPSR1
SCHEMBL27166109 0.87 PROKR1 (0.44) MGLLPDE4BMEN1KMT2A
SCHEMBL30055357 0.87 MGLL (0.40) MGLLPDE4BHSD11B1MEN1KMT2A
SCHEMBL27166064 0.87 MGLL (0.40) MGLLPDE4BHSD11B1MEN1KMT2A

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-12637471-B2 Heterocyclic compounds, compositions, methods of preparation and uses thereof ORGANON R&D FINLAND LTD. (FI) 2026-05-26 US disclosed
EP-4334289-B1 NOVEL HETEROCYCLIC COMPOUNDS, COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF Organon R&D Finland Oy (FI) 2025-06-25 EP disclosed
US-20240254131-A1 NOVEL HETEROCYCLIC COMPOUNDS, COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF ORGANON R&D FINLAND LTD. (FI) 2024-08-01 US disclosed
CN-117794899-A Novel heterocyclic compounds, compositions, methods of preparation and uses thereof 欧加农研发芬兰有限公司 2024-03-29 CN 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-20240254131-A1 NOVEL HETEROCYCLIC COMPOUNDS, COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF AKR1C3, AKR1C4, AKR1C1 MGLL 1354/4885PDE4B 698/4885HSD11B1 17/4885
US-12637471-B2 Heterocyclic compounds, compositions, methods of preparation and uses thereof AKR1C3, AKR1C4, AKR1C2 MGLL 450/4885PDE4B 1133/4885HSD11B1 11/4885

“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.