SCHEMBL1358607

SCHEMBL1358607

CC(C)c1c(C(C)C)c(C(C)C)c2c(C(C)C)cccc2c1C(C)C.[Na]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.41
LMNA P02545 3/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRB2 P47870 2/20 0.41
FAAH O00519 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2C P28335 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
HTR2B P41595 1/20 0.41
GABRA2 P47869 1/20 0.41

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
SCHEMBL10710755 0.98 GABRA1 (0.43) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL7923602 0.84 GABRA1 (0.39) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL7923598 0.77 CYP2A6 (0.44) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL7595117 0.76 FABP3 (0.41) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL6272853 0.76 FABP3 (0.41) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL6326670 0.72 FABP3 (0.41) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL1070380 0.71 KIF11 (0.40) GABRA1LMNAGABRB2CYP1A2HPGD
SCHEMBL30381967 0.71 GABRA1 (0.57) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL66227 0.71 GABRA1 (0.57) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL4657600 0.71 GABRA1 (0.57) GABRA1LMNAGABRG2GABRB3GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2580211-B1 PROCESS FOR THE PREPARATION OF DIHYDROPYRROLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2015-08-19 EP disclosed
EP-2331535-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-07-22 EP disclosed
EP-2331515-B1 INSCETICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-07-10 EP disclosed
EP-2518068-A2 Insecticidal compounds Syngenta Participations AG. (CH) 2012-10-31 EP disclosed
EP-2297136-B1 INSECTICIDAL PYRIDYLPIPERIDINE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2011-12-28 EP disclosed
US-20110288131-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-11-24 US disclosed
EP-2260708-A2 Insecticidal mixture containing gamma-cyhalothrin Syngenta Limited (GB) 2010-12-15 EP disclosed
US-6548233-B1 Comprising a hydrophilic binder and a non-crystalline reducing agent for reducing silver ions, can be formulated in aqueous coating compositions to provide photothermographic materials EASTMAN KODAK COMPANY 2003-04-15 US disclosed
EP-0858261-B1 PROCESS FOR THE PREPARATION OF A GRANULE SYNGENTA LTD (GB) 2001-07-25 EP disclosed
EP-1035431-A1 Cyan coupler and combination solvent-containing photographic element and process EASTMAN KODAK COMPANY (US) 2000-09-13 EP disclosed
US-5004494-A Fungicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-02 US disclosed
EP-0278595-A2 Fungicides ZENECA LIMITED (GB) 1988-08-17 EP disclosed
EP-0207590-A2 Substituted azolyl ethanol derivatives as plant growth regulators IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-01-07 EP disclosed
EP-0206523-A1 Heterocyclic compounds as fungicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-12-30 EP disclosed
US-4496388-A FUNGICIDES; PLANT GROWTH REGULATORS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-01-29 US disclosed
EP-0028465-A1 Acylanilide compounds, methods for their preparation, compositions containing them, and processes for combatting fungi IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-05-13 EP disclosed
EP-0015639-A2 Enantiomers of triazole compounds, a process for preparing them, their use as plant fungicides and growth regulating agents and compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-09-17 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 (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-20110288131-A1 INSECTICIDAL COMPOUNDS ACHE, CHRM1, ITPR3 GABRA1 3431/4885LMNA 1380/4885GABRG2 3758/4885

“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.