SCHEMBL5704572

SCHEMBL5704572

Cc1cc(O)c(C(C)C)cc1[C@]1(C)CC[C@@H](C(C)C)[C@H](O)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
MAPT P10636 4/20 0.37
CYP1A2 P05177 3/20 0.37
CYP2D6 P10635 3/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
ALOX15 P16050 2/20 0.37
CYP2C19 P33261 2/20 0.37
HIF1A Q16665 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TP53 P04637 1/20 0.37
PAX8 Q06710 1/20 0.37
CDK2 P24941 1/20 0.36
PKM P14618 3/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
THRB P10828 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL29760431 0.79 TRPA1 (0.36) LMNACYP3A4
SCHEMBL18262861 0.78 LMNA (0.50) LMNAMAPTCYP1A2CYP2D6CYP3A4
SCHEMBL2911019 0.69 ESR2 (0.36)
SCHEMBL27416248 0.67 LMNA (0.45) LMNAMAPTCYP1A2CYP2D6CYP3A4
SCHEMBL8501660 0.67 SLC18A3 (0.42) MAPTNPSR1KMT2AMEN1
SCHEMBL18262841 0.67 LMNA (0.45) LMNAMAPTCYP1A2CYP2D6CYP3A4
SCHEMBL7113263 0.67 SLC6A3 (0.41) MAPTNPSR1KMT2AMEN1ALDH1A1
SCHEMBL21724095 0.67 SLC6A3 (0.41) MAPTNPSR1KMT2AMEN1ALDH1A1
SCHEMBL27988103 0.65 LMNA (0.46) LMNAMAPTCYP1A2CYP2D6CYP3A4
SCHEMBL4953880 0.65 LMNA (0.42) LMNAMAPTCYP1A2CYP2D6CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116338038-A Method for detecting thymol content of triamcinolone acetonide and neomycin plaster and quality control method 杭州市食品药品检验研究院 2023-06-27 CN disclosed
CN-116249530-A Use of active substances with antiviral, antimalarial and/or mucolytic properties for inhalation by soft mist inhalers or vibrating mesh technology nebulizers for the treatment of viral lung diseases including covd-19 伊斯坦布尔大学 2023-06-09 CN disclosed
US-11286415-B2 Downhole fluid for removing scales and methods thereof HALLIBURTON ENERGY SERVICES, INC. (US) 2022-03-29 US disclosed
US-20210093561-A1 DENTAL CARE CANNABIS DEVICE AND USE THEREOF BUZZELET DEVELOPMENT AND TECHNOLOGIES LTD (IL) 2021-04-01 US disclosed
US-20200255719-A1 Downhole Fluid for Removing Scales and Methods Thereof HALLIBURTON ENERGY SERVICES, INC. (US) 2020-08-13 US disclosed
EP-1700617-A1 Composition for activating the hair follicules and use thereof Dr. Kurt Wolff GmbH & Co. KG (DE) 2006-09-13 EP disclosed