SCHEMBL9466533

SCHEMBL9466533

CC(C)CCC[C@@H](C)CCC[C@@H](C)CO

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.68
BLM P54132 1/20 0.54
PTPN1 P18031 3/20 0.52
TSHR P16473 2/20 0.50
MEN1 O00255 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
KMT2A Q03164 1/20 0.47
PTPN2 P17706 1/20 0.35
CDC25B P30305 1/20 0.35
GBA1 P04062 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
NR1I2 O75469 1/20 0.33

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
SCHEMBL11359162 1.00 LMNA (0.68) LMNABLMPTPN1TSHRMEN1
SCHEMBL9756758 1.00 LMNA (0.68) LMNABLMPTPN1TSHRMEN1
SCHEMBL5702262 1.00 LMNA (0.68) LMNABLMPTPN1TSHRMEN1
SCHEMBL11363905 1.00 LMNA (0.68) LMNABLMPTPN1TSHRMEN1
SCHEMBL11574108 0.97 LMNA (0.74) LMNABLMPTPN1TSHRMEN1
SCHEMBL16548164 0.97 LMNA (0.65) LMNABLMPTPN1TSHRMEN1
SCHEMBL114059 0.97 LMNA (0.63) LMNABLMPTPN1TSHRMEN1
SCHEMBL3995713 0.97 LMNA (0.63) LMNABLMPTPN1TSHRMEN1
Alcohol SCHEMBL11707824 0.95 LMNA (0.62) LMNABLMPTPN1TSHRMEN1
SCHEMBL20503660 0.92 LMNA (0.63) LMNABLMPTPN1TSHRMEN1

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0316374-B1 OPTICALLY ACTIVE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 1991-07-31 EP claimed
EP-0316374-A1 OPTICALLY ACTIVE COMPOUNDS. HOFFMANN LA ROCHE (CH) 1989-05-24 EP claimed
WO-1988008838-A1 OPTICALLY ACTIVE COMPOUNDS F. HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) 1988-11-17 WO claimed
US-5243096-A Optically active pentane derivatives and intermediates thereof, and process for manufacturing same ASAHI DENKA KOGYO K.K. (JP) 1993-09-07 US disclosed
US-5136061-A Optically active pentane derivatives and intermediates thereof, and process for manufacturing same ASAHI DENKA KOGYO K.K. (JP) 1992-08-04 US disclosed
EP-0316374-B1 OPTICALLY ACTIVE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 1991-07-31 EP disclosed
EP-0316374-A1 OPTICALLY ACTIVE COMPOUNDS. HOFFMANN LA ROCHE (CH) 1989-05-24 EP disclosed
WO-1988008838-A1 OPTICALLY ACTIVE COMPOUNDS F. HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) 1988-11-17 WO disclosed
US-4277610-A Synthesis of 2,6,10-trimethyl-undecan-1-ol HOFFMANN-LA ROCHE INC. (US) 1981-07-07 US disclosed
US-4191842-A Protected alcohols HOFFMANN-LA ROCHE INC. (US) 1980-03-04 US disclosed
US-4180682-A Unsaturated alcohols having an ether protected group HOFFMANN-LA ROCHE INC. (US) 1979-12-25 US disclosed
US-4086249-A Tetramethyl chromanyl pentane amide HOFFMANN-LA ROCHE INC. (US) 1978-04-25 US disclosed
US-4076739-A Synthesis of vitamin E HOFFMANN-LA ROCHE INC. (US) 1978-02-28 US disclosed
US-4051153-A Intermediates in the synthesis of vitamin E HOFFMANN-LA ROCHE INC. (US) 1977-09-27 US disclosed
US-4041058-A Synthesis of 2,6,10-trimethyl-undecan-1-ol HOFFMANN-LA ROCHE INC. (US) 1977-08-09 US disclosed
US-4026907-A INTERMEDIATES FOR ALPHA-TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-05-31 US disclosed
US-4018799-A INTERMEDIATES FOR TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-04-19 US disclosed
US-4016178-A Synthesis of vitamin E HOFFMANN-LA ROCHE INC. (US) 1977-04-05 US disclosed
US-4003919-A INTERMEDIATES FOR ALPHA-TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-01-18 US disclosed
US-3947473-A (6-HYDROXY-CHROMAN-2-YL) CARBOXYLIC ACID DERIVATIVES HOFFMAN-LA ROCHE INC. (US) 1976-03-30 US disclosed