SCHEMBL11009487

SCHEMBL11009487

COC(=O)c1cccc(-c2cn3c(n2)sc2ccccc23)c1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 5/20 0.56
▸ MAPT P10636 4/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ TSHR P16473 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ ATM Q13315 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ POLB P06746 1/20 0.51
▸ THRB P10828 2/20 0.50
▸ RXFP1 Q9HBX9 2/20 0.50
▸ USP2 O75604 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ FLT3 P36888 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49

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
SCHEMBL11006118 0.89 MAPT (0.56) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL11010621 0.87 TP53 (0.56) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL24105991 0.87 TP53 (0.67) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL11012504 0.85 MAPT (0.51) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL24106012 0.83 THRB (0.70) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL11015064 0.81 TP53 (0.73) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL11005976 0.80 TP53 (0.55) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL11007567 0.80 ADORA2A (0.61) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL9837374 0.80 RAB9A (0.53) TP53MAPTSMN1; SMN2TSHRLMNA
SCHEMBL9569354 0.80 MAPT (0.56) TP53MAPTSMN1; SMN2TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4497817-A ANTIALLERGENS-IMMUNOSUPPRESSIVE AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1985-02-05 — — US claimed
EP-0144341-A4 NOVEL 4,5-g(a)EPOXYMORPHINAN-6-SPIRO-2'-(4'-CARBOXY,1',3'-THIAZOLIDINE) DERIVATIVES. KEY PHARMA (US) 1985-07-30 — — EP disclosed
EP-0144341-A1 NOVEL 4,5-g(a)EPOXYMORPHINAN-6-SPIRO-2'-(4'-CARBOXY,1',3'-THIAZOLIDINE) DERIVATIVES. KEY PHARMA (US) 1985-06-19 — — EP disclosed
US-4497817-A ANTIALLERGENS-IMMUNOSUPPRESSIVE AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1985-02-05 — — US disclosed
WO-1984003627-A1 NOVEL 4,5alphaEPOXYMORPHINAN-6-SPIRO-2'-(4'-CARBOXY,1',3'-THIAZOLIDINE) DERIVATIVES KEY PHARMA (US) 1984-09-27 — — WO disclosed
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