SCHEMBL8768818

SCHEMBL8768818

Cc1ccc(C(C)(C)CC(C)(C)C)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.64
TSHR P16473 2/20 0.52
CYP3A4 P08684 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ACHE P22303 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
CYP2D6 P10635 2/20 0.40
HIF1A Q16665 2/20 0.40
MAPT P10636 3/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
BCHE P06276 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 2/20 0.36
MDH1 P40925 1/20 0.36

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
SCHEMBL16769400 0.84 SHBG (0.48) SHBGTSHRCYP3A4SMN1; SMN2MAPT
SCHEMBL14848456 0.83 SHBG (0.47) SHBGTSHRCYP3A4SMN1; SMN2CYP2D6
SCHEMBL14825135 0.83 SHBG (0.47) SHBGTSHRCYP3A4SMN1; SMN2CYP2D6
SCHEMBL18286393 0.83 SHBG (0.47) SHBGTSHRCYP3A4SMN1; SMN2CYP2D6
SCHEMBL10515698 0.82 SHBG (0.67) SHBGTSHRCYP3A4SMN1; SMN2ACHE
SCHEMBL14685623 0.81 TSHR (0.48) SHBGTSHRCYP3A4SMN1; SMN2ACHE
SCHEMBL19872296 0.81 TSHR (0.48) SHBGTSHRCYP3A4SMN1; SMN2ACHE
SCHEMBL9245740 0.81 TSHR (0.48) SHBGTSHRCYP3A4SMN1; SMN2ACHE
SCHEMBL14357618 0.80 CYP3A4 (0.51) SHBGCYP3A4SMN1; SMN2MAPTNPC1
Toluene SCHEMBL22609037 0.80 SHBG (0.75) SHBGTSHRCYP3A4SMN1; SMN2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240010590-A1 Methods for preparing and purifying environmentally compatible detergents TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-01-11 US disclosed
EP-4192806-A1 METHODS FOR PREPARING AND PURIFYING ENVIRONMENTALLY COMPATIBLE DETERGENTS Takeda Pharmaceutical Company Limited (JP) 2023-06-14 EP disclosed
US-20230102593-A1 METHODS FOR CONTROLLING ROOT PARASITIC WEEDS: INHIBITORS OF SEED GERMINATION IN STRIGA KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2023-03-30 US disclosed
US-11324216-B2 Methods for controlling root parasitic weeds: inhibitors of seed germination in Striga KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2022-05-10 US disclosed
WO-2022029674-A1 METHODS FOR PREPARING AND PURIFYING ENVIRONMENTALLY COMPATIBLE DETERGENTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-02-10 WO disclosed
US-20210112807-A1 METHODS FOR CONTROLLING ROOT PARASITIC WEEDS: INHIBITORS OF SEED GERMINATION IN STRIGA KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2021-04-22 US disclosed
EP-3609328-A1 METHODS FOR CONTROLLING ROOT PARASITIC WEEDS: INHIBITORS OF SEED GERMINATION INSTRIGA King Abdullah University Of Science And Technology (SA) 2020-02-19 EP disclosed
WO-2018189638-A1 METHODS FOR CONTROLLING ROOT PARASITIC WEEDS: INHIBITORS OF SEED GERMINATION IN STRIGA KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2018-10-18 WO disclosed
EP-0659738-B1 N-(Carbonyl, carbonimidoyl, carbonothioyl) sulfonamide charge control agents and toners and developers EASTMAN KODAK CO (US) 1997-09-10 EP disclosed
US-5616797-A USED IN ELECTROPHOTOGRAPHY EASTMAN KODAK COMPANY (US) 1997-04-01 US disclosed
EP-0659738-A1 N-(Carbonyl, carbonimidoyl, carbonothioyl) sulfonamide charge control agents and toners and developers EASTMAN KODAK COMPANY (US) 1995-06-28 EP disclosed
US-5405727-A Electrophotography EASTMAN KODAK COMPANY (US) 1995-04-11 US disclosed
US-4424400-A Oligoisobutylcyclohexane, a process for its preparation and its use BAYER AKTIENGESELLSCHAFT (DE) 1984-01-03 US disclosed
EP-0036121-B1 OLIGO-ISOBUTYL CYCLOHEXANE, PROCESS FOR ITS PRODUCTION AND ITS USE BAYER AG (DE) 1983-10-19 EP disclosed
EP-0036121-A1 Oligo-isobutyl cyclohexane, process for its production and its use BAYER AG (DE) 1981-09-23 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 (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-20240010590-A1 Methods for preparing and purifying environmentally compatible detergents HDHD5, LIPA, ABHD16A SHBG 1653/4885TSHR 4493/4885CYP3A4 1759/4885
US-11324216-B2 Methods for controlling root parasitic weeds: inhibitors of seed germination in Striga CROCC, PTPRG, GRIK5 SHBG 324/4885TSHR 247/4885CYP3A4 2996/4885
US-20230102593-A1 METHODS FOR CONTROLLING ROOT PARASITIC WEEDS: INHIBITORS OF SEED GERMINATION IN STRIGA CROCC, PTPRG, GRIK5 SHBG 324/4885TSHR 247/4885CYP3A4 2996/4885
US-20210112807-A1 METHODS FOR CONTROLLING ROOT PARASITIC WEEDS: INHIBITORS OF SEED GERMINATION IN STRIGA CROCC, PTPRG, GRIK5 SHBG 324/4885TSHR 247/4885CYP3A4 2996/4885

“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.