SCHEMBL21154355

SCHEMBL21154355

Oc1ccccc1Cc1ccc2c(c1)OCO2

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 2/20 0.54
KEAP1 Q14145 1/20 0.53
CYP3A4 P08684 2/20 0.52
VKORC1 Q9BQB6 1/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 2/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
HPGD P15428 1/20 0.49
CYP2D6 P10635 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
HSPA5 P11021 1/20 0.48

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
SCHEMBL29180146 0.87 CALM1 (0.55) CALM1CYP3A4VKORC1MEN1KMT2A
SCHEMBL21154364 0.85 CALM1 (0.65) CALM1CYP3A4MEN1KMT2AALDH1A1
SCHEMBL14284011 0.83 CALM1 (0.53) CALM1CYP3A4ALDH1A1GAAMAPT
SCHEMBL30576424 0.82 CYP3A4 (0.59) CALM1CYP3A4MEN1KMT2AALDH1A1
SCHEMBL1846305 0.82 CYP3A4 (0.59) CALM1CYP3A4MEN1KMT2AALDH1A1
SCHEMBL28505386 0.80 CALM1 (0.51) CALM1VKORC1MEN1KMT2AALDH1A1
SCHEMBL6724285 0.80 CYP3A4 (0.51) CALM1CYP3A4KMT2AALDH1A1GAA
SCHEMBL9672470 0.80 TAAR1 (0.53) CALM1CYP3A4KMT2AALDH1A1MAPT
SCHEMBL109195 0.80 TAAR1 (0.64) CYP3A4ALDH1A1GAAMAPTCYP2D6
SCHEMBL1422874 0.79 ALDH1A1 (0.58) CALM1CYP3A4ALDH1A1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120052403-A Extraction method and application of piper nigrum polyphenol with pseudomonas mycelial inhibitory activity 中国热带农业科学院香料饮料研究所 2025-05-30 CN disclosed
CN-119156138-A Vapor treatment of agricultural products 阿比尔技术公司 2024-12-17 CN disclosed
CN-117320559-A Edible coating with antimicrobial properties 阿比尔技术公司 2023-12-29 CN disclosed
CN-116042552-A Laccase and preparation method thereof, and preparation method of magnolol 嘉兴欣贝莱生物科技有限公司 2023-05-02 CN disclosed
EP-3542780-B1 SERIES OF SKIN-WHITENING (LIGHTENING) COMPOUNDS UNIGEN INC (US) 2022-01-19 EP disclosed
CN-110607077-B Bio-based thermosetting resin composite material and preparation method thereof SOUTHWEST PETROLEUM UNIVERSITY (CN) 2021-08-31 CN disclosed
CN-110730819-A Improved production of cells of muscle lineage and therapeutic uses thereof 索尼克马斯特有限公司 2020-01-24 CN disclosed
CN-110607077-A Bio-based thermosetting resin composite material and preparation method thereof 西南石油大学 2019-12-24 CN disclosed
EP-3542780-A1 SERIES OF SKIN-WHITENING (LIGHTENING) COMPOUNDS Unigen, Inc. (US) 2019-09-25 EP disclosed
EP-2323612-B1 SERIES OF SKIN-WHITENING (LIGHTENING) COMPOUNDS UNIGEN INC (US) 2019-07-10 EP disclosed