SCHEMBL3115802

SCHEMBL3115802

C=CCCCCC(O)CC

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 4/20 0.49
ALDH1A1 P00352 3/20 0.49
MAPT P10636 3/20 0.49
CYP3A4 P08684 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 3/20 0.46
ABCC4 O15439 1/20 0.35
LMNA P02545 2/20 0.35
RECQL P46063 1/20 0.35
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
GPR84 Q9NQS5 4/20 0.32

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
SCHEMBL17494179 0.98 USP2 (0.51) USP2ALDH1A1MAPTCYP3A4SMN1; SMN2
SCHEMBL8483019 0.98 USP2 (0.51) USP2ALDH1A1MAPTCYP3A4SMN1; SMN2
SCHEMBL3116470 0.98 USP2 (0.51) USP2ALDH1A1MAPTCYP3A4SMN1; SMN2
SCHEMBL3123238 0.98 USP2 (0.51) USP2ALDH1A1MAPTCYP3A4SMN1; SMN2
SCHEMBL3111942 0.98 USP2 (0.51) USP2ALDH1A1MAPTCYP3A4SMN1; SMN2
SCHEMBL18052645 0.93
SCHEMBL2467501 0.93
SCHEMBL6905587 0.93
3-Octanol SCHEMBL28698995 0.92 TSHR (0.61) USP2ALDH1A1MAPTCYP3A4SMN1; SMN2
SCHEMBL29204812 0.91 USP2 (0.46) USP2ALDH1A1MAPTCYP3A4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108017353-A Gunite concrete and preparation method thereof 四川通德商品混凝土有限公司 2018-05-11 CN claimed
CN-106924224-A A kind of pharmaceutical composition for treating craniocerebral injury caused by mental disorder and its application 新乡医学院 2017-07-07 CN claimed
US-6369248-B1 HYDROXY ESTERS FOR PERFUMES GIVAUDAN SA (CH) 2002-04-09 US claimed
EP-0953562-A1 Beta, gamma-unsaturated delta-keto esters Givaudan Roure (International) S.A. (CH) 1999-11-03 EP claimed
CN-111278821-B Spiro compounds as farnesol X receptor modulators 百时美施贵宝公司 2023-10-03 CN disclosed
CN-111278821-A Spiro compounds as farnesoid X receptor modulators 百时美施贵宝公司 2020-06-12 CN disclosed
US-20180265805-A1 RELEASE OF ODORIFEROUS SUBSTANCES FROM MICROCAPSULES HENKEL AG & CO. KGAA (DE) 2018-09-20 US disclosed
EP-3350306-A1 RELEASE OF ODORIFEROUS SUBSTANCES FROM MICROCAPSULES Henkel AG & Co. KGaA (DE) 2018-07-25 EP disclosed
CN-108012543-A Polypeptide and their polynucleotides of coding with lipase active 诺维信公司 2018-05-08 CN disclosed
EP-3233821-A1 ORTHOFORMIC ACID ESTERS AS PRO-FRAGRANCES Henkel AG & Co. KGaA (DE) 2017-10-25 EP disclosed
CN-107109382-A Detergent compositions, lipase variants, and polynucleotides encoding same 诺维信公司 2017-08-29 CN disclosed
CN-107072900-A High spreadability, the malodor counteracting compound of low smell and application method 国际香料和香精公司 2017-08-18 CN disclosed
WO-2002076605-A1 METHOD FOR PRODUCING ENCAPSULATIONS SYMRISE GMBH & CO. KG (DE) 2002-10-03 WO disclosed
EP-1244748-A1 WAX FORMULATIONS CONTAINING ODORIFEROUS SUBSTANCES Symrise GmbH & Co. KG (DE) 2002-10-02 EP disclosed
WO-2002024857-A1 MULTI-PHASE SOAP HAARMANN & REIMER GMBH (DE) 2002-03-28 WO disclosed
WO-2002019983-A2 CLEANSING/CONDITIONING AGENTS CONTAINING MATRIX PARTICLES WITH A PERFUME COMPONENT AND A WASHING-ACTIVE COMPONENT HAARMANN & REIMER GMBH (DE) 2002-03-14 WO disclosed
EP-1186619-A2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition contaning the copolymer, and uses thereof Mitsui Chemicals, Inc. (JP) 2002-03-13 EP disclosed
WO-2002012157-A1 NOVEL MACROCYCLIC KETONES HAARMANN & REIMER GMBH (DE) 2002-02-14 WO disclosed
WO-2001038440-A1 WAX FORMULATIONS CONTAINING ODORIFEROUS SUBSTANCES HAARMANN & REIMER GMBH (DE) 2001-05-31 WO disclosed
EP-0953562-A1 Beta, gamma-unsaturated delta-keto esters Givaudan Roure (International) S.A. (CH) 1999-11-03 EP disclosed