SCHEMBL29958353

SCHEMBL29958353

CCC(C)c1cocc1C(C)CC

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
RORC P51449 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
SCHEMBL11683236 0.73 TSHR (0.50) TSHRRORC
SCHEMBL826704 0.69 GABRA1 (0.35) TSHR
SCHEMBL994607 0.69 TSHR (0.73) TSHRRORC
SCHEMBL18649878 0.67 ALOX15 (0.30)
SCHEMBL891384 0.67 TSHR (0.44) TSHRRORC
SCHEMBL11682514 0.67 TSHR (0.50) TSHRRORC
SCHEMBL23665812 0.66 TSHR (0.44) TSHRRORC
SCHEMBL8053657 0.65
SCHEMBL10319645 0.65 TSHR (0.59) TSHRRORC
Hydrogen Peroxide SCHEMBL3675725 0.65 TSHR (0.74) TSHRRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359382-A1 TWO-STEP SYNTHESIS OF PYRROLE COMPOUNDS FROM FURAN COMPOUNDS Chevron Phillips Chemical Company LP (US) 2024-05-01 EP disclosed
CN-117881658-A Two-step synthesis of pyrrole compounds from furan compounds 切弗朗菲利浦化学公司 2024-04-12 CN disclosed
WO-2022197944-A1 TWO-STEP SYNTHESIS OF PYRROLE COMPOUNDS FROM FURAN COMPOUNDS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2022-09-22 WO disclosed