SCHEMBL97315

SCHEMBL97315

O=CCCC=Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.52
ALDH1A1 P00352 3/20 0.48
TRPA1 O75762 1/20 0.48
LMNA P02545 1/20 0.48
ALOX5 P09917 1/20 0.48
MAPK1 P28482 1/20 0.48
SIGMAR1 Q99720 2/20 0.47
IDO1 P14902 2/20 0.47
MAOB P27338 2/20 0.44
CYP2A6 P11509 1/20 0.44
HTR2A P28223 3/20 0.44

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
SCHEMBL2399949 1.00 PAM (0.52) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL4485977 1.00 PAM (0.52) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL10430031 0.88 IDO1 (0.56) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL7939387 0.88 IDO1 (0.56) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL7568412 0.88 IDO1 (0.56) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL31634334 0.88 HDAC2 (0.44) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL97322 0.87 PAM (0.48) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL22245646 0.87 PAM (0.48) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL97135 0.87 PAM (0.48) PAMALDH1A1TRPA1LMNAALOX5
SCHEMBL5485532 0.85 PAM (0.47) PAMALDH1A1TRPA1LMNAALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101348926-A Plating solution for electroplating matt zinc and preparation thereof WUHAN AOBANG SURFACE TECH CO L (CN) 2009-01-21 CN claimed
US-4097615-A ORGANOLEPTIC, AROMA AND TASTE ENHANCING INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-06-27 US claimed
US-4064280-A Flavoring with α-oxy(oxo)mercaptans INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-12-20 US claimed
US-4064278-A FRUIT AND VEGETABLE FOODSTUFFS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-12-20 US claimed
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 claimed
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 claimed
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 claimed
US-4044164-A BERRY, CEREAL, NUT, BROCCOLI, ONION, CITRUS, JASMIN, MILK CARAMEL, GRAPE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-08-23 US claimed
US-4036886-A FROM A PHENYL ALKENYL BROMIDE AND LITHIUM SALT OF A SCHIFF BASE OF ACETALDEHYDE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-07-19 US claimed
US-4024289-A Flavoring with α-oxy(oxo)mercaptans INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-05-17 US claimed
CN-120192218-A Ring-opening hydroformylation reaction of benzylidene cyclopropane with formic acid as carbonyl source 常州大学 2025-06-24 CN disclosed
CN-119822936-A Method for degrading high polymer material containing carbon-carbon double bond 浙江大学 2025-04-15 CN disclosed
EP-2349560-B1 POLYMER-SUPPORTED TRANSITION METAL CATALYST COMPLEXES AND METHODS OF USE UNIV KANSAS (US) 2025-01-22 EP disclosed
CN-117916227-A Process for preparing perfuming intermediates 弗门尼舍有限公司 2024-04-19 CN disclosed
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN 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
US-4036886-A FROM A PHENYL ALKENYL BROMIDE AND LITHIUM SALT OF A SCHIFF BASE OF ACETALDEHYDE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-07-19 US disclosed
US-4031140-A FLAVORS, ODORS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-06-21 US disclosed
US-4024289-A Flavoring with α-oxy(oxo)mercaptans INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-05-17 US disclosed