SCHEMBL22181736

SCHEMBL22181736

CC(C)C(F)(C(=O)NCC(O)CO)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL20692421 0.79 LMNA (0.33) LMNACYP2C19HIF1A
SCHEMBL27081436 0.77 ALDH1A1 (0.46) LMNACYP2C19HIF1A
SCHEMBL3139336 0.77 ALDH1A1 (0.46) LMNACYP2C19HIF1A
SCHEMBL14612349 0.76 ALDH1A1 (0.32) LMNACYP2C19HIF1A
SCHEMBL26198162 0.74 LMNA (0.36) LMNACYP2C19HIF1A
SCHEMBL25590205 0.74 LMNA (0.36) LMNACYP2C19HIF1A
SCHEMBL3464664 0.74 LMNA (0.36) LMNACYP2C19HIF1A
SCHEMBL22181540 0.72 PLA2G2C (0.36)
SCHEMBL2745754 0.71 CA2 (0.35) LMNACYP2C19HIF1A
SCHEMBL26023515 0.69 RIPK1 (0.42) LMNACYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200207921-A1 DIBLOCK COPOLYMER, A MANUFACTURING METHOD AND SUITED APPLICATIONS FREIE UNIVERSITÄT BERLIN (DE) 2020-07-02 US disclosed