SCHEMBL21914895

SCHEMBL21914895

C=C(C)COCC1CC2CC1C1C3C=CC(C3)C21

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL25591030 0.82
SCHEMBL13902788 0.80
SCHEMBL21914894 0.78 ALDH1A1 (0.41)
SCHEMBL18973451 0.78
SCHEMBL14117766 0.77
SCHEMBL30209907 0.77
SCHEMBL10899734 0.77 NLRP3 (0.33)
SCHEMBL12220758 0.76
SCHEMBL30210048 0.75 SMN1; SMN2 (0.37)
SCHEMBL24004646 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018298-A1 OLEFINIC COMPOSITIONS COMPRISING HYDROCARBON RESINS ExxonMobil Product Solutions Company 2024-01-18 US disclosed
US-20220127491-A1 COATING COMPOSITIONS ExxonMobil Product Solutions Company 2022-04-28 US disclosed
US-20210347935-A1 POLYMERS FOR SPECIALTY APPLICATIONS ExxonMobil Product Solutions Company 2021-11-11 US disclosed
WO-2020072776-A1 POLYMERS FOR SPECIALTY APPLICATIONS MATERIA, INC. (US) 2020-04-09 WO disclosed