SCHEMBL8054946

SCHEMBL8054946

Cc1cccc(C)c1N1CCCCC1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.45
▸ ACHE P22303 1/20 0.45
▸ SMN1; SMN2 Q16637 6/20 0.43
▸ HTT P42858 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ NCOA3 Q9Y6Q9 1/20 0.43
▸ MAPT P10636 3/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ TP53 P04637 2/20 0.41
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ GAA P10253 2/20 0.40
▸ JAK3 P52333 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ CRHBP P24387 1/20 0.39

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
SCHEMBL10391741 0.76 HTR2C (0.42) ACHESMN1; SMN2HTTMAPTKDM4E
SCHEMBL16307930 0.75 HTR2C (0.37) HTTLMNAMAPTL3MBTL1ALDH1A1
SCHEMBL20283585 0.74 AR (0.51) BCHEACHESMN1; SMN2HTTLMNA
SCHEMBL8053460 0.74 GFER (0.53) SMN1; SMN2LMNAMAPTTP53MAOA
SCHEMBL29512725 0.74 SMARCA2 (0.41) BCHEACHESMN1; SMN2HTTLMNA
SCHEMBL28589000 0.74 KCNK3 (0.44) HTTLMNAMAPTKDM4EALDH1A1
SCHEMBL3261010 0.74 KCNK3 (0.44) HTTLMNAMAPTKDM4EALDH1A1
SCHEMBL7075696 0.73 MAOA (0.60) BCHEACHESMN1; SMN2HTTLMNA
SCHEMBL28588999 0.73 POLB (0.37) HTTLMNAMAPTL3MBTL1ALDH1A1
SCHEMBL28767881 0.73 POLB (0.37) HTTLMNAMAPTL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6143288-A USING BORNEOL, OR RACEMIC MIXTURE THEREOF INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2000-11-07 — — US disclosed
EP-1042953-A2 Use of acyclic and carbocylic ketones, alcohols, aldehydes, nitriles and esters for repelling or attracting insects INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2000-10-11 — — EP disclosed
EP-0629344-B1 Acyclic and carbocyclic ketones, alcohols, aldehydes nitriles and esters and uses thereof for their insect repellency and attractancy properties INT FLAVORS & FRAGRANCES INC (US) 1998-10-28 — — EP disclosed
EP-0815728-A2 Acyclic and carbocyclic ketones, alcohols, aldehydes, nitriles and esters and uses thereof for their insect repellency properties INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1998-01-07 — — EP disclosed
US-5635174-A USING JASMINE ABSOLUTE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1997-06-03 — — US disclosed
US-5635173-A EXPOSING THE ENVIRONMENT SURROUNDING THE TRAP TO AN INSECT ATTRACTANT CONTAINING A MIXTURE OF BIODEGRADABLE POLYCAPROLACTONE OR POLYURETHANE AND D-LIMONENE INTERNATIONAL FLAVORS & FRAGRANCES (US) 1997-06-03 — — US disclosed
US-5633236-A SILANEDIOL, BORATE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1997-05-27 — — US disclosed
EP-0660667-B1 INSECT REPELLENT COMPOSITIONS AND METHODS FOR USING SAME INT FLAVORS & FRAGRANCES INC (US) 1997-04-23 — — EP disclosed
US-5521165-A HETEROCYCLIC ORGANOBORON DERIVATIVES IN A POLYMER MATRIX INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1996-05-28 — — US disclosed
US-5472701-A Used as soaps, candles for flies, mosquitoes; washing mammals INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1995-12-05 — — US disclosed
US-5464626-A EXPOSING A THREE-DIMENSIONAL SPACE TO A SPECIFIED CARBONATE COMPOUND INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1995-11-07 — — US disclosed
EP-0660667-A1 INSECT REPELLENT COMPOSITIONS AND METHODS FOR USING SAME. INT FLAVORS & FRAGRANCES INC (US) 1995-07-05 — — EP disclosed
US-5401500-A House flies attracted with benzoin group and dimethyl benzyl carbinyl acetate INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1995-03-28 — — US disclosed
EP-0629344-A2 Acyclic and carbocyclic ketones, alcohols, aldehydes nitriles and esters and uses thereof for their insect repellency and attractancy properties INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1994-12-21 — — EP disclosed
WO-1994006295-A1 INSECT REPELLENT COMPOSITIONS AND METHODS FOR USING SAME INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1994-03-31 — — WO disclosed
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