SCHEMBL8399530

SCHEMBL8399530

C[C@H](N)C(=O)Oc1ccccc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
GAA P10253 5/20 0.42
KMT2A Q03164 3/20 0.42
POLB P06746 1/20 0.42
JAK2 O60674 2/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.40
CA12 O43570 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
IDO1 P14902 2/20 0.38

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
SCHEMBL1627869 0.87 ALOX15 (0.47) CA1CA2TP53TSHRGAA
SCHEMBL10713156 0.85 CA1 (0.48) CA1CA2TP53TSHRGAA
SCHEMBL352382 0.83 CA1 (0.47) CA1CA2TP53TSHRGAA
SCHEMBL28842455 0.81 TSHR (0.46) TSHRGAAKMT2AMAPTIRAK4
SCHEMBL5058437 0.81 TDP1 (0.46) KMT2AIRAK4ALDH1A1KDM4EHPGD
SCHEMBL3199566 0.81 KMT2A (0.51) CA1CA2KMT2APOLBMAPT
SCHEMBL5062924 0.81 TDP1 (0.46) KMT2AIRAK4ALDH1A1KDM4EHPGD
SCHEMBL7976424 0.81 KMT2A (0.51) CA1CA2KMT2APOLBMAPT
SCHEMBL1983875 0.81 TSHR (0.46) TSHRGAAKMT2AMAPTIRAK4
SCHEMBL1983996 0.80 LMNA (0.39) TSHRGAAKMT2AMAPTLMNA

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
CN-117298352-A Medical coating and preparation method and application thereof 广东省科学院生物与医学工程研究所 2023-12-29 CN claimed
CN-109276348-A For encapsulating the bone implant of bone material 华沙整形外科股份有限公司 2019-01-29 CN disclosed
CN-108997927-A Preparation method with hydrophilic, antibacterial, transparent package material surface film coating autonomous layer by layer 西北工业大学 2018-12-14 CN disclosed
CN-108546237-A A method of extracting levodopa by raw material of cat beans 那坡康正天然植物提取有限责任公司 2018-09-18 CN disclosed
US-5919318-A NITROBENZENESULFONIC ACID HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1999-07-06 US disclosed