SCHEMBL7685427

SCHEMBL7685427

CCN(CC)Cc1nc2sc3c(c2c(-c2ccc(OC)c(OC)c2)c1Cl)CCN(Cc1ccccc1)C3

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 2/20 0.45
▸ BRD4 O60885 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ POLB P06746 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ ACHE P22303 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ BLM P54132 1/20 0.42
▸ RUNX1 Q01196 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ CBFB Q13951 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ TDP1 Q9NUW8 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
SCHEMBL7001809 0.90 MKNK1 (0.48) MKNK1BRD4KDM4EALDH1A1POLB
SCHEMBL7490401 0.90 NT5E (0.46) BRD4KDM4EALDH1A1POLBHPGD
SCHEMBL7681367 0.89 MKNK1 (0.47) MKNK1BRD4KDM4EALDH1A1POLB
SCHEMBL7683235 0.88 MKNK1 (0.45) MKNK1BRD4KDM4EALDH1A1POLB
SCHEMBL7687553 0.88 MKNK1 (0.46) MKNK1BRD4KDM4EALDH1A1POLB
SCHEMBL7683303 0.88 MKNK1 (0.47) MKNK1BRD4KDM4EALDH1A1POLB
SCHEMBL7487295 0.87 LMNA (0.52) BRD4KDM4EALDH1A1POLBHPGD
SCHEMBL6999278 0.86 BRD4 (0.47) MKNK1BRD4KDM4EALDH1A1POLB
SCHEMBL7684149 0.86 MKNK1 (0.45) MKNK1BRD4KDM4EALDH1A1POLB
SCHEMBL7679304 0.85 MKNK1 (0.48) MKNK1BRD4

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-6403606-B1 ANTIINFLAMMATORY, ANTIARTHRITIS, A DRUG FOR INHIBITING BONE RESORPTION, IMMUNOSUPPRESSANT TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2002-06-11 — — US disclosed
US-6046189-A ANTI-INFLAMMATORY DRUG, PARTICULARLY, A DRUG FOR PREVENTING OR TREATING ARTHRITIS, A DRUG FOR INHIBITING BONE RESORPTION, IMMUNOSUPPRESSANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-04-04 — — US disclosed
EP-0900223-A1 THIENOPYRIDINE DERIVATIVES AND THEIR USE Takeda Chemical Industries, Ltd. (JP) 1999-03-10 — — EP disclosed
WO-1997040050-A1 THIENOPYRIDINE DERIVATIVES AND THEIR USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-30 — — WO disclosed
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