SCHEMBL8208668

SCHEMBL8208668

CCCCC(Br)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ LMNA P02545 3/20 0.46
▸ TSHR P16473 3/20 0.46
▸ CYP3A4 P08684 2/20 0.45
▸ CYP2D6 P10635 2/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ MAPT P10636 1/20 0.44
▸ ACHE P22303 1/20 0.44
▸ GRM8 O00222 3/20 0.43
▸ GRM4 Q14833 3/20 0.43
▸ ACP3 P15309 1/20 0.43
▸ SLC6A2 P23975 1/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ SLC6A3 Q01959 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
SCHEMBL15675484 0.91 TSHR (0.48) L3MBTL1MEN1HPGDKMT2ALMNA
SCHEMBL7009326 0.84 TSHR (0.52) L3MBTL1MEN1HPGDKMT2ALMNA
SCHEMBL19339253 0.84 L3MBTL1 (0.60) L3MBTL1MEN1HPGDKMT2ALMNA
SCHEMBL21201087 0.83 TSHR (0.50) L3MBTL1MEN1HPGDKMT2ALMNA
SCHEMBL29867321 0.83 TSHR (0.50) L3MBTL1MEN1HPGDKMT2ALMNA
SCHEMBL28490652 0.82 L3MBTL1 (0.46) L3MBTL1MEN1HPGDKMT2ALMNA
SCHEMBL7732979 0.81 LMNA (0.47) L3MBTL1MEN1HPGDKMT2ALMNA
SCHEMBL2744792 0.81 POLB (0.37) CYP3A4ALDH1A1KDM4E
SCHEMBL28795751 0.80 TSHR (0.53) L3MBTL1MEN1HPGDKMT2ALMNA
SCHEMBL11786819 0.78 KMT2A (0.45) L3MBTL1MEN1HPGDKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6071935-A Derivatives of 2-(2-oxo-ethylidene)-imidazolidin-4-one and their use as farnesyl protein transferase inhibitors PFIZER INC. (US) 2000-06-06 — — US disclosed
EP-0907649-A1 DERIVATIVES OF 2-(2-OXO-ETHYLIDENE)-IMIDAZOLIDIN-4-ONE AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS PFIZER INC. (US) 1999-04-14 — — EP disclosed
WO-1997049700-A1 DERIVATIVES OF 2-(2-OXO-ETHYLIDENE)-IMIDAZOLIDIN-4-ONE AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS PFIZER INC. (US) 1997-12-31 — — WO disclosed
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