SCHEMBL11601577

SCHEMBL11601577

CCCC(O)C(CC)CS

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
TSHR P16473 1/20 0.30

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
SCHEMBL5556231 0.84 LMNA (0.75) LMNATSHR
SCHEMBL20298310 0.81 LMNA (0.71) LMNATSHR
SCHEMBL22863857 0.81
Ethohexadiol SCHEMBL6282991 0.77 LMNA (1.00) LMNATSHR
Ethohexadiol SCHEMBL38007 0.77 LMNA (1.00) LMNATSHR
Ethohexadiol SCHEMBL20787860 0.75 LMNA (0.95) LMNATSHR
Ethohexadiol SCHEMBL610774 0.75 LMNA (0.95) LMNATSHR
Ethohexadiol SCHEMBL11502837 0.75 LMNA (0.95) LMNATSHR
SCHEMBL811914 0.75 LMNA (0.62) LMNATSHR
Ethohexadiol SCHEMBL10731659 0.75 LMNA (0.95) LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4119788-A ODORS, FLAVORS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-10-10 US disclosed
US-4107197-A KETONE REACTED WITH SULFURYL CHLORIDE, ALPHA-CHLORO KETONE REACTED WITH ALKALI METAL COMPOUND INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-08-15 US disclosed
US-4097615-A ORGANOLEPTIC, AROMA AND TASTE ENHANCING INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-06-27 US disclosed
US-4097396-A Soaps and detergents containing alpha-oxy(oxo)sulfides as perfumes INTERNATIONAL FLAVORS & FRAGRANCES, INC. (US) 1978-06-27 US disclosed
US-4097532-A ENHANCING FLAVOR AND AROMA INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-06-27 US disclosed
US-4094824-A α-Oxy(oxo) sulfides in perfume INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-06-13 US disclosed
US-4088697-A 3-PROPYLTHIO-4-HEPTANOL; FOODSTUFF FLAVORS OR ODORANTS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-05-09 US disclosed
US-4083862-A α-Oxy(oxo) sulfides and ethers INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-04-11 US disclosed
US-4065408-A α-Oxy(oxo) sulfide perfume and cologne compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-12-27 US disclosed
US-4061796-A Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-12-06 US disclosed
US-4061795-A Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-12-06 US disclosed
US-4055691-A Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-10-25 US disclosed
US-4053655-A Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-10-11 US disclosed
US-4053654-A Uses of α-oxy(oxo) sulfides and ethers in foodstuffs and flavors for foodstuffs INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-10-11 US disclosed
US-4045491-A PERFUMES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-08-30 US disclosed
US-4044164-A BERRY, CEREAL, NUT, BROCCOLI, ONION, CITRUS, JASMIN, MILK CARAMEL, GRAPE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-08-23 US disclosed