SCHEMBL9515076

SCHEMBL9515076

CC(C)(C)c1ccccc1OCO

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.55
KDM4E B2RXH2 4/20 0.55
GAA P10253 4/20 0.53
RXRA P19793 1/20 0.53
RXRB P28702 1/20 0.53
RXRG P48443 1/20 0.53
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MAPT P10636 3/20 0.51
NPSR1 Q6W5P4 3/20 0.49
NAMPT P43490 1/20 0.49
NISCH Q9Y2I1 1/20 0.47
TDP1 Q9NUW8 5/20 0.45
HTT P42858 3/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
ATM Q13315 1/20 0.45

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
SCHEMBL9551460 0.88 ALDH1A1 (0.44) ALDH1A1KDM4EGAARXRARXRB
SCHEMBL8142983 0.84 ALDH1A1 (0.65) ALDH1A1KDM4EGAARXRARXRB
SCHEMBL16195513 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EGAARXRARXRB
SCHEMBL6763906 0.81 CYP1A2 (0.53) ALDH1A1KDM4EGAARXRARXRB
SCHEMBL11006202 0.80 ALDH1A1 (0.73) ALDH1A1KDM4EGAARXRARXRB
SCHEMBL2095584 0.79 RXRA (0.53) RXRARXRBRXRGL3MBTL1
SCHEMBL19441062 0.79 CYP1A2 (0.51) ALDH1A1KDM4EGAARXRARXRB
SCHEMBL13050673 0.79 CYP1A2 (0.51) ALDH1A1KDM4EGAARXRARXRB
SCHEMBL5735923 0.79 CYP1A2 (0.51) ALDH1A1KDM4EGAARXRARXRB
SCHEMBL16094351 0.79 CYP1A2 (0.51) ALDH1A1KDM4EGAARXRARXRB

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
US-20220218878-A1 CONTROLLED HEAT DELIVERY COMPOSITIONS BAMBU VAULT LLC (US) 2022-07-14 US claimed
WO-2020243047-A1 CONTROLLED HEAT DELIVERY COMPOSITIONS BAMBU VAULT LLC (US) 2020-12-03 WO claimed
CN-119053612-A Method for purifying siloxane containing hydroxyl group and (meth) acryloyl group and siloxane composition containing hydroxyl group and (meth) acryloyl group 信越化学工业株式会社 2024-11-29 CN disclosed
US-20240000782-A1 METHODS AND COMPOSITIONS FOR TREATING AN OPHTHALMIC CONDITION TELIOS PHARMA, INC. (US) 2024-01-04 US disclosed
EP-4255569-A1 METHODS AND COMPOSITIONS FOR TREATING AN OPHTHALMIC CONDITION Telios Pharma, Inc. (US) 2023-10-11 EP disclosed
CN-116829150-A Methods and compositions for treating ocular conditions 泰利奥斯制药公司 2023-09-29 CN disclosed
US-20220362381-A1 REMOTELY TRIGGERED THERAPY BAMBU VAULT LLC (US) 2022-11-17 US disclosed
US-20220287949-A1 SAFE PARTICLES FOR THE INTRODUCTION OF USEFUL CHEMICAL AGENTS IN THE BODY WITH CONTROLLED ACTIVATION BAMBU VAULT LLC (US) 2022-09-15 US disclosed
US-20220226253-A1 SAFE PARTICLES FOR THE INTRODUCTION OF USEFUL CHEMICAL AGENTS IN THE BODY WITH CONTROLLED ACTIVATION BAMBU VAULT LLC (US) 2022-07-21 US disclosed
US-20220229065-A1 SENSORS AND METHODS FOR RAPID MICROBIAL DETECTION BAMBU VAULT LLC (US) 2022-07-21 US disclosed
US-20220218878-A1 CONTROLLED HEAT DELIVERY COMPOSITIONS BAMBU VAULT LLC (US) 2022-07-14 US disclosed
US-20200390889-A1 REMOTELY TRIGGERED THERAPY BAMBU VAULT LLC (US) 2020-12-17 US disclosed
WO-2020243047-A1 CONTROLLED HEAT DELIVERY COMPOSITIONS BAMBU VAULT LLC (US) 2020-12-03 WO disclosed
WO-2020123656-A1 METHODS AND COMPOSITIONS OF TREATING AN OPHTHALMIC CONDITION KARTOS THERAPEUTICS (US) 2020-06-18 WO disclosed
WO-2017046598-A1 TREATMENT OF ACUTE INFLAMMATORY DISORDERS IMPERIAL INNOVATIONS LIMITED (GB) 2017-03-23 WO disclosed
EP-3085757-A1 STABILIZATION OF ALKOXYLATED POLYTETRAHYDROFURANES WITH ANTIOXIDANTS BASF SE (DE) 2016-10-26 EP disclosed
EP-0189049-B2 Stabilization of palm kernel oil fatty-acid methyl esters for their processing into subsequent reaction products with a neutral colour HENKEL KGAA (DE) 1993-12-15 EP disclosed
EP-0473823-A1 Laminate and process for producing the same SHOWA DENKO KABUSHIKI KAISHA (JP) 1992-03-11 EP disclosed
EP-0189049-B1 STABILIZATION OF PALM KERNEL OIL FATTY-ACID METHYL ESTERS FOR THEIR PROCESSING INTO SUBSEQUENT REACTION PRODUCTS WITH A NEUTRAL COLOUR Henkel Kommanditgesellschaft auf Aktien (DE) 1990-08-01 EP disclosed
EP-0189049-A1 Stabilization of palm kernel oil fatty-acid methyl esters for their processing into subsequent reaction products with a neutral colour Henkel Kommanditgesellschaft auf Aktien (DE) 1986-07-30 EP 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 (5 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-20200390889-A1 REMOTELY TRIGGERED THERAPY CD47, IFNG, TLR9 ALDH1A1 3552/4885KDM4E 4290/4885GAA 1436/4885
US-20220362381-A1 REMOTELY TRIGGERED THERAPY CD47, HSP90AA1, HSF1 ALDH1A1 1357/4885KDM4E 2640/4885GAA 1118/4885
US-20240000782-A1 METHODS AND COMPOSITIONS FOR TREATING AN OPHTHALMIC CONDITION BTK, SYK, LCK ALDH1A1 3952/4885KDM4E 1813/4885GAA 1358/4885
US-20220226253-A1 SAFE PARTICLES FOR THE INTRODUCTION OF USEFUL CHEMICAL AGENTS IN THE BODY WITH CONTROLLED ACTIVATION CTSA, CES2, ACHE ALDH1A1 632/4885KDM4E 4793/4885GAA 101/4885
US-20220287949-A1 SAFE PARTICLES FOR THE INTRODUCTION OF USEFUL CHEMICAL AGENTS IN THE BODY WITH CONTROLLED ACTIVATION MPO, CUTA, LPO ALDH1A1 220/4885KDM4E 4626/4885GAA 73/4885

“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.