SCHEMBL6575823

SCHEMBL6575823

NC(O)Cc1ccc(CC(N)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 5/20 0.48
SLC6A2 P23975 4/20 0.48
SLC6A4 P31645 3/20 0.46
EPHX1 P07099 1/20 0.43
SLC7A5 Q01650 2/20 0.43
SLC6A3 Q01959 2/20 0.42
ALPI P09923 1/20 0.41
PKM P14618 1/20 0.41
PTGS1 P23219 1/20 0.41
XIAP P98170 1/20 0.41
MAOA P21397 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
CYP2A6 P11509 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40

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
SCHEMBL21357615 0.89 TAAR1 (0.64) TAAR1SLC6A2SLC7A5
SCHEMBL21632218 0.89 TAAR1 (0.64) TAAR1SLC6A2SLC7A5
SCHEMBL11229692 0.89 ABAT (0.50) TAAR1SLC6A2SLC6A3
SCHEMBL10876390 0.89 GFER (0.48) TAAR1SLC6A2SLC6A4MAOA
SCHEMBL1048764 0.89 TAAR1 (0.64) TAAR1SLC6A2SLC7A5
Hydrochloric Acid SCHEMBL10616562 0.87 TAAR1 (0.61) TAAR1SLC6A2SLC7A5
SCHEMBL10763436 0.87 SLC6A4 (0.67) TAAR1SLC6A2SLC6A4SLC6A3
Sulfuric Acid SCHEMBL7639969 0.87 SLC7A5 (0.41) TAAR1SLC6A2SLC6A4SLC7A5ALPI
SCHEMBL1239401 0.87 TRPA1 (0.50) TAAR1SLC6A2
SCHEMBL3041534 0.87 TAAR1 (0.44) TAAR1SLC6A2SLC6A4EPHX1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3727599-B1 COMPOSITION FOR DYEING KERATIN FIBERS CONTAINING A COMBINATION OF A P-PHENYLENE DERIVATIVE AND 2,7-NAPHTHALENEDIOL AND USE THEREOF FOR REDUCING A YELLOW TINGE IN A HAIRSTYLE LABORATOIRE BIOSTHETIQUE KOSMETIK GMBH&CO KG (DE) 2023-03-22 EP claimed
US-20200368129-A1 COMPOSITION FOR DYEING KERATIN FIBERS CONTAINING A COMBINATION OF A P-PHENYLENE DERIVATIVE AND 2,7-NAPHTHALENEDIOL AND USE THEREOF FOR REDUCING A YELLOW TINGE IN A HAIRSTYLE LABORATOIRE BIOSTHETIQUE KOSMETIK GMBH & CO. KG (DE) 2020-11-26 US claimed
EP-3727599-A1 COMPOSITION FOR DYEING KERATIN FIBERS CONTAINING A COMBINATION OF A P-PHENYLENE DERIVATIVE AND 2,7-NAPHTHALENEDIOL AND USE THEREOF FOR REDUCING A YELLOW TINGE IN A HAIRSTYLE Laboratoire Biosthetique Kosmetik GmbH&Co. KG (DE) 2020-10-28 EP claimed
EP-3727599-B1 COMPOSITION FOR DYEING KERATIN FIBERS CONTAINING A COMBINATION OF A P-PHENYLENE DERIVATIVE AND 2,7-NAPHTHALENEDIOL AND USE THEREOF FOR REDUCING A YELLOW TINGE IN A HAIRSTYLE LABORATOIRE BIOSTHETIQUE KOSMETIK GMBH&CO KG (DE) 2023-03-22 EP disclosed
US-20200368129-A1 COMPOSITION FOR DYEING KERATIN FIBERS CONTAINING A COMBINATION OF A P-PHENYLENE DERIVATIVE AND 2,7-NAPHTHALENEDIOL AND USE THEREOF FOR REDUCING A YELLOW TINGE IN A HAIRSTYLE LABORATOIRE BIOSTHETIQUE KOSMETIK GMBH & CO. KG (DE) 2020-11-26 US disclosed
EP-3727599-A1 COMPOSITION FOR DYEING KERATIN FIBERS CONTAINING A COMBINATION OF A P-PHENYLENE DERIVATIVE AND 2,7-NAPHTHALENEDIOL AND USE THEREOF FOR REDUCING A YELLOW TINGE IN A HAIRSTYLE Laboratoire Biosthetique Kosmetik GmbH&Co. KG (DE) 2020-10-28 EP disclosed
EP-0920853-B1 Hair dye compositions P & G CLAIROL INC (US) 2004-01-21 EP disclosed
EP-0920853-A1 Hair dye compositions Bristol-Myers Squibb Company (US) 1999-06-09 EP disclosed