Isobutane

Isobutane

SCHEMBL996078

CC(C)C.COc1cnccn1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
MEN1 O00255 1/20 0.36
HSP90AA1 P07900 1/20 0.36
PLAU P00749 1/20 0.35
LMNA P02545 1/20 0.35
SIRT6 Q8N6T7 1/20 0.34
LOX P28300 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
APLNR P35414 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34

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
SCHEMBL391812 0.93
SCHEMBL29445963 0.93
SCHEMBL13359011 0.93 MAPT (0.45) MAPTSMN1; SMN2KDM4EKMT2AHTT
Ammonia Solution, Strong SCHEMBL28148961 0.91
Ethane SCHEMBL5007888 0.91 MAPT (0.44) MAPTSMN1; SMN2KDM4EKMT2AHTT
Ammonia Solution, Strong SCHEMBL27633176 0.88 MAPT (0.42) MAPTSMN1; SMN2KDM4EKMT2AHTT
Formaldehyde SCHEMBL27596059 0.86 MAPT (0.45) MAPTSMN1; SMN2KDM4EKMT2AHTT
SCHEMBL16972758 0.86 ATM (0.39) MAPTSMN1; SMN2KDM4EKMT2AALDH1A1
Butane SCHEMBL18670328 0.84 MAPT (0.41) MAPTSMN1; SMN2KDM4EKMT2AHTT
Butadiene SCHEMBL896495 0.83 MAPT (0.43) MAPTSMN1; SMN2KDM4EKMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025226566-A1 INSTANT WHITE COFFEE STARBUCKS CORPORATION (US) 2025-10-30 WO claimed
CN-120121743-A Method for judging Luzhou-flavor liquor in Yibin producing area 江南大学 2025-06-10 CN claimed
CN-119715844-A Method for determining odor substances by combining sodium thiosulfate pretreatment with headspace solid-phase microextraction and gas chromatography mass spectrometry 哈尔滨工业大学 2025-03-28 CN claimed
CN-119655345-A Coffee replica made from a single component 航行食品股份有限公司 2025-03-21 CN claimed
CN-119413785-A Color developing card for qualitatively and quantitatively determining fishy smell degradation degree of burdock drug and preparation and use methods thereof 江苏省农业科学院 2025-02-11 CN claimed
CN-116478851-B Burdock powder flavor improvement strain and preparation method of microbial powder starter thereof 江苏省农业科学院 2024-08-23 CN claimed
CN-116478851-A Burdock powder flavor improvement strain and preparation method of microbial powder starter thereof 江苏省农业科学院 2023-07-25 CN claimed
CN-107983318-B Preparation of adsorbent for adsorbing earthy mildew peculiar smell and application of adsorbent in adsorbing and reducing earthy mildew peculiar smell in freshwater fish body 三峡大学 2020-07-07 CN claimed
EP-3353272-A1 PERFUME COMPOSITIONS Givaudan SA (CH) 2018-08-01 EP claimed
US-20180187123-A1 Perfume Compositions GIVAUDAN S.A. (CH) 2018-07-05 US claimed
WO-2017050971-A1 PERFUME COMPOSITIONS GIVAUDAN SA (CH) 2017-03-30 WO claimed
WO-2014010791-A1 SCENT COMPOSITION FOR FEED LIM SEUNG WOOK (KR) 2014-01-16 WO claimed
EP-3110754-B1 HIGHLY MESOPOROUS ACTIVATED CARBON CARBON TECH HOLDINGS LLC (US) 2026-04-15 EP disclosed
US-12441953-B2 Isomer mixtures of unsaturated macrocyclic musk compounds SYMRISE AG (DE) 2025-10-14 US disclosed
EP-3898910-B1 ALICYCLIC MUSK FRAGRANCE COMPOUNDS SYMRISE AG (DE) 2025-09-03 EP disclosed
US-20250256260-A1 HIGHLY MESOPOROUS ACTIVATED CARBON Carbon Technology Holdings, LLC 2025-08-14 US disclosed
EP-1788896-A1 HEAT STABLE FLAVOURING COMPOSITIONS Quest International Services B.V. (NL) 2007-05-30 EP disclosed
WO-2006025742-A1 HEAT STABLE FLAVOURING COMPOSITIONS QUEST INTERNATIONAL SERVICES B.V. (NL) 2006-03-09 WO disclosed
EP-0913383-B1 New spirocyclic compounds GIVAUDAN SA (CH) 2001-09-05 EP disclosed
EP-0913383-A1 New spirocyclic compounds Givaudan Roure (International) S.A. (CH) 1999-05-06 EP disclosed