SCHEMBL29611127

SCHEMBL29611127

O=C1C(O)=C(O)C(=O)c2c(O)cc(O)cc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 1/20 0.62
▸ MCL1 Q07820 1/20 0.62
▸ ESR1 P03372 6/20 0.60
▸ ESR2 Q92731 6/20 0.60
▸ MEN1 O00255 3/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ MAPT P10636 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ POLB P06746 2/20 0.60
▸ CYP3A4 P08684 2/20 0.60
▸ APEX1 P27695 2/20 0.60
▸ MAPK1 P28482 2/20 0.60
▸ TDP1 Q9NUW8 2/20 0.60
▸ ELANE P08246 2/20 0.60
▸ NPC1 O15118 1/20 0.60
▸ PTP4A3 O75365 1/20 0.60
▸ GMNN O75496 1/20 0.60
▸ LMNA P02545 1/20 0.60
▸ TP53 P04637 1/20 0.60
▸ CYP1A1 P04798 1/20 0.60

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
SCHEMBL5810073 1.00 BCL2 (0.62) BCL2MCL1ESR1ESR2MEN1
SCHEMBL2771631 0.88 BCL2 (0.76) BCL2MCL1ESR1ESR2MEN1
SCHEMBL29390162 0.86 ESR1 (0.77) BCL2MCL1ESR1ESR2MEN1
SCHEMBL5968219 0.86 ESR1 (0.77) BCL2MCL1ESR1ESR2MEN1
SCHEMBL17866794 0.84 ESR1 (0.62) BCL2MCL1ESR1ESR2MEN1
SCHEMBL32681444 0.80 BCL2 (0.71) BCL2MCL1ESR1ESR2MEN1
SCHEMBL29598332 0.78 BCL2 (0.53) BCL2MCL1ESR1ESR2MEN1
SCHEMBL10401591 0.78 ESR1 (0.67) BCL2MCL1ESR1ESR2MEN1
SCHEMBL2595625 0.78 BCL2 (0.58) BCL2MCL1ESR1ESR2MEN1
SCHEMBL9175356 0.78 BCL2 (0.69) BCL2MCL1ESR1ESR2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4440313-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PHYTOPATHOGENIC INFECTIONS Institut national de recherche pour l'agriculture, L'alimentation et l'environnement (INRAE) (FR) 2024-10-09 — — EP disclosed
CN-118714927-A Compositions and methods for controlling phytopathogenic infection 法国国家农业食品与环境研究院 2024-09-27 — — CN disclosed
CN-107847466-B Formulations and methods for modulating wound healing 贝欧曼蒂克丝公司 2024-02-06 — — CN disclosed
WO-2023099609-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PHYTOPATHOGENIC INFECTIONS INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (INRAE) (FR) 2023-06-08 — — WO disclosed
CN-109310648-B Compositions comprising cannabidiol and a second therapeutic agent for treating cancer 杰伊制药公司 2022-06-03 — — CN disclosed
Send feedback