SCHEMBL8716134

SCHEMBL8716134

[CH2]C(CCCCCCCC)(CCCCCCCC)CCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
THRB P10828 1/20 0.50
GGPS1 O95749 6/20 0.48
FDPS P14324 9/20 0.41
SMPD1 P17405 2/20 0.39
CES2 O00748 1/20 0.39
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 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
SCHEMBL28085782 1.00 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL9808555 1.00 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL7253883 1.00 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL28857305 1.00 TSHR (0.50) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL28445910 0.97 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL6989967 0.97 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL27669639 0.97 GGPS1 (0.44) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL27377628 0.94 GGPS1 (0.44) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL29064055 0.88 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL8670374 0.88 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111247141-A Epoxy-oxetane compound, method for synthesizing same, and use of same 四国化成工业株式会社 2020-06-05 CN disclosed
EP-2791099-B1 PRODUCTION OF ACETIC ACID WITH ENHANCED CATALYST STABILITY CELANESE INT CORP (US) 2017-02-01 EP disclosed
US-8916727-B2 Production of acetic acid with enhanced catalyst stability CELANESE INTERNATIONAL CORPORATION (US) 2014-12-23 US disclosed
EP-2791099-A1 PRODUCTION OF ACETIC ACID WITH ENHANCED CATALYST STABILITY Celanese International Corporation (US) 2014-10-22 EP disclosed
US-20130184491-A1 Production of Acetic Acid with Enhanced Catalyst Stability CELANESE INTERNATIONAL CORPORATION (US) 2013-07-18 US disclosed
WO-2013090720-A1 PRODUCTION OF ACETIC ACID WITH ENHANCED CATALYST STABILITY CELANESE INTERNATIONAL CORPORATION (US) 2013-06-20 WO disclosed
US-5753730-A Plastic lenses having a high-refractive index, process for the preparation thereof and casting polymerization process for preparing sulfur-containing urethane resin lens and lens prepared thereby MITSUI TOATSU CHEMICALS, INC. (JP) 1998-05-19 US 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 (1 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-20130184491-A1 Production of Acetic Acid with Enhanced Catalyst Stability ACADM, CA6, ADH5 TSHR 2810/4885THRB 3428/4885GGPS1 2158/4885

“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.