SCHEMBL3870840

SCHEMBL3870840

O=C1c2ccccc2CC1Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.50
METAP1 P53582 4/20 0.42
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
HTR7 P34969 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP19A1 P11511 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL29850498 0.78 ACHE (0.58) ACHEMETAP1CYP19A1TSHR
SCHEMBL1567503 0.78 ACHE (0.58) ACHEMETAP1CYP19A1TSHR
Hydrochloric Acid SCHEMBL6601125 0.76 ACHE (0.56) ACHEMETAP1HTR7CYP19A1TSHR
SCHEMBL5175924 0.75 HRH3 (0.51) ACHEMETAP1
SCHEMBL5175319 0.75 ACHE (0.53) ACHEMETAP1
SCHEMBL3602309 0.75 ACHE (0.46) ACHEMETAP1CYP19A1TSHR
SCHEMBL942998 0.75 ACHE (0.46) ACHEMETAP1SMN1; SMN2CYP19A1TSHR
SCHEMBL9248465 0.74 ACHE (0.53) ACHEMETAP1SMN1; SMN2CYP19A1TSHR
SCHEMBL15670682 0.74 ACHE (0.53) ACHEMETAP1HTR7CYP19A1TSHR
SCHEMBL10710886 0.73 ACHE (0.45) ACHEMETAP1SMN1; SMN2CYP19A1TSHR

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101121702-A Phenoxy indanone derivatives containing alkylamino side-chain, preparation method and use thereof UNIV ZHEJIANG (CN) 2008-02-13 CN claimed
CN-100364961-C Phenoxyhydrindone derivatives containing nitrogen and preparation and use thereof UNIV ZHEJIANG (CN) 2008-01-30 CN claimed
US-20060182731-A1 Nicotine in therapeutic angiogenesis and vasculogenesis THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2006-08-17 US claimed
US-20060167028-A1 Nicotine in therapeutic angiogenesis and vasculogenesis THE BOARD OF TRUSTEES OF THE LELAND STANFORD JR. UNIVERSITY 2006-07-27 US claimed
CN-1680279-A Phenoxyhydrindone derivatives containing nitrogen and preparation and use thereof UNIV ZHEJIANG (CN) 2005-10-12 CN claimed
EP-4021391-B1 NOVEL COMPOUNDS FOR SKIN LIGHTENING UNILEVER GLOBAL IP LTD (GB) 2024-01-17 EP disclosed
US-20220313581-A1 NOVEL COMPOUNDS FOR SKIN LIGHTENING Conopco, Inc. , d/b/a UNILEVER (US) 2022-10-06 US disclosed
US-20220280405-A1 NOVEL COMPOUNDS FOR SKIN LIGHTENING Conopco, Inc. , d/b/a UNILEVER (US) 2022-09-08 US disclosed
EP-4021899-A1 NOVEL COMPOUNDS FOR SKIN LIGHTENING Unilever Global IP Limited (GB) 2022-07-06 EP disclosed
EP-4021391-A1 NOVEL COMPOUNDS FOR SKIN LIGHTENING Unilever Global IP Limited (GB) 2022-07-06 EP disclosed
WO-2021037759-A1 NOVEL COMPOUNDS FOR SKIN LIGHTENING UNILEVER GLOBAL IP LIMITED (GB) 2021-03-04 WO disclosed
WO-2021037750-A1 NOVEL COMPOUNDS FOR SKIN LIGHTENING UNILEVER GLOBAL IP LIMITED (GB) 2021-03-04 WO disclosed
CN-101121702-A Phenoxy indanone derivatives containing alkylamino side-chain, preparation method and use thereof UNIV ZHEJIANG (CN) 2008-02-13 CN disclosed
CN-100364961-C Phenoxyhydrindone derivatives containing nitrogen and preparation and use thereof UNIV ZHEJIANG (CN) 2008-01-30 CN disclosed
CN-100364961-C Phenoxyhydrindone derivatives containing nitrogen and preparation and use thereof UNIV ZHEJIANG (CN) 2008-01-30 CN disclosed
CN-1277809-C Benzal indone and benzyl indone derivative(s), and its preparing method and use UNIV ZHEJIANG (CN) 2006-10-04 CN disclosed
US-20060182731-A1 Nicotine in therapeutic angiogenesis and vasculogenesis THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2006-08-17 US disclosed
US-20060167028-A1 Nicotine in therapeutic angiogenesis and vasculogenesis THE BOARD OF TRUSTEES OF THE LELAND STANFORD JR. UNIVERSITY 2006-07-27 US disclosed
CN-1709860-A Benzal indone and benzyl indone derivative(s), and its preparing method and use UNIV ZHEJIANG (CN) 2005-12-21 CN disclosed
CN-1680279-A Phenoxyhydrindone derivatives containing nitrogen and preparation and use thereof UNIV ZHEJIANG (CN) 2005-10-12 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220280405-A1 NOVEL COMPOUNDS FOR SKIN LIGHTENING CUTA, NQO1, TYR ACHE 168/4885METAP1 1510/4885DDB1 793/4885
US-20220313581-A1 NOVEL COMPOUNDS FOR SKIN LIGHTENING TYR, LRAT, NQO1 ACHE 129/4885METAP1 1218/4885DDB1 568/4885
US-20060167028-A1 Nicotine in therapeutic angiogenesis and vasculogenesis TEK, FLT4, FLT1 ACHE 2361/4885METAP1 2271/4885DDB1 4172/4885
US-20060182731-A1 Nicotine in therapeutic angiogenesis and vasculogenesis TEK, FLT4, FLT1 ACHE 2361/4885METAP1 2271/4885DDB1 4172/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.