SCHEMBL6341

SCHEMBL6341

COc1ccc(CO[C]=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.55
AGXT P21549 2/20 0.55
APP P05067 5/20 0.48
HTT P42858 1/20 0.48
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAOB P27338 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CALM1 P0DP23 1/20 0.46
CMA1 P23946 1/20 0.46
LTA4H P09960 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
FFAR1 O14842 1/20 0.45

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
SCHEMBL6510845 0.89 PTGS2 (0.46) IDO1AGXTAPPHTTNPC1
SCHEMBL1456261 0.89 PTGS2 (0.46) IDO1AGXTAPPHTTNPC1
SCHEMBL9306727 0.81 APP (0.40) IDO1AGXTAPPHTTNPC1
SCHEMBL208838 0.80 NQO1 (0.54) NPC1POLBRAB9ASMN1; SMN2CA12
SCHEMBL9532692 0.80 TAAR1 (0.52) IDO1NPC1RAB9ASMN1; SMN2MAOB
SCHEMBL11324512 0.79 ABCB1 (0.62) APPNPC1RAB9A
SCHEMBL10254222 0.79 IDO1 (0.55) IDO1AGXTAPPHTTMAOB
SCHEMBL8853 0.79 ALDH1A1 (0.46) POLBCALM1
SCHEMBL2245598 0.79 IDO1 (0.55) IDO1AGXTAPPHTTNPC1
SCHEMBL2095384 0.79 POLB (0.51) NPC1POLBRAB9A

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

Appears in 19086 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118164998-A Sesquiterpene lactone scaberol C dithio carbamate derivative and preparation method and application thereof 沈阳药科大学 2024-06-11 CN claimed
CN-118164996-A Sesquiterpene lactone scaberol C selenoether derivative, preparation method and application thereof 沈阳药科大学 2024-06-11 CN claimed
CN-118164997-A Sesquiterpene lactone scaberol C thioether derivative, and preparation method and application thereof 沈阳药科大学 2024-06-11 CN claimed
WO-2024110477-A2 SYNTHESIS OF A CYCLIC PEPTIDE JANSSEN PHARMACEUTICA NV (BE) 2024-05-30 WO claimed
US-20240124461-A1 PROCESSES FOR THE PREPARATION OF ZANUBRUTINIB AND INTERMEDIATES THEREOF ASSIA CHEMICAL INDUSTRIES LTD. (IL) 2024-04-18 US claimed
US-11932666-B2 Polymerizable compound, compound, and method for producing boranophosphate oligomer TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2024-03-19 US claimed
EP-4282973-A2 PROCESSES FOR THE PREPARATION OF PYRIMIDINYLCYCLOPENTANE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2023-11-29 EP claimed
EP-4259633-A1 PROCESSES FOR THE PREPARATION OF ZANUBRUTINIB AND INTERMEDIATES THEREOF Teva Pharmaceuticals International GmbH (CH) 2023-10-18 EP claimed
WO-2023167545-A1 POLYBENZIMIDAZOLE WITH PROTECTING GROUPS, PREPARATION METHOD FOR MEMBRANE USING THE SAME AND USE THEREOF 한국화학연구원 2023-09-07 WO claimed
CN-116478165-A Crystal form of compound, preparation and application thereof 百济神州(苏州)生物科技有限公司 2023-07-25 CN claimed
US-4009159-A PENICILLINS FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1977-02-22 US claimed
US-3998795-A (Acyl-D-α-amino acid-gly-gly-tyr-ala)1 -somatostatin AMERICAN HOME PRODUCTS CORPORATION (US) 1976-12-21 US claimed
US-3997517-A PEPTIDE AMERICAN HOME PRODUCTS CORPORATION (US) 1976-12-14 US claimed
US-3993646-A Process for the ring expansion of penicillins to cephalosporin compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1976-11-23 US claimed
US-3984417-A Method of producing active amino acid esters AJINOMOTO CO., INC. (JA) 1976-10-05 US claimed
US-3978063-A 1,2,3,4-Tetrahydroisoquinoline derivatives and the preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1976-08-31 US claimed
US-3951951-A Azetidinones BEECHAM GROUP LIMITED (EN) 1976-04-20 US claimed
US-3933783-A Formation of peptide bonds in the presence of isonitriles AJINOMOTO CO., INC. (JA) 1976-01-20 US claimed
US-3933784-A Des-(ser13)-srif and intermediates AMERICAN HOME PRODUCTS CORPORATION (US) 1976-01-20 US claimed
US-3931140-A (H-gly-gly-tyr-ala)1 -somatostatin AMERICAN HOME PRODUCTS CORPORATION (US) 1976-01-06 US claimed