SCHEMBL16062677

SCHEMBL16062677

CC(C)OC(=O)CCN1CCN(CCC(=O)OCCCCCCOC(=O)CCN2CCNCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.39
▸ HRH2 P25021 2/20 0.38
▸ HRH1 P35367 2/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ CHRM5 P08912 1/20 0.35
▸ CHRM3 P20309 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ITGB3 P05106 1/20 0.35
▸ ITGA2B P08514 1/20 0.35
▸ THRB P10828 3/20 0.34
▸ THRA P10827 2/20 0.34

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
SCHEMBL14012690 0.89 CHRM5 (0.39) LMNAHRH2HRH1MEN1KMT2A
SCHEMBL22743444 0.87 HRH2 (0.42) HRH2HRH1MEN1KMT2AALDH1A1
SCHEMBL6603994 0.87 CHRM5 (0.44) LMNAHRH2HRH1MEN1KMT2A
SCHEMBL22743451 0.85 HRH2 (0.39) HRH2HRH1MEN1KMT2ACHRM5
SCHEMBL16062671 0.85 HRH2 (0.45) LMNAHRH2HRH1MEN1KMT2A
SCHEMBL16062673 0.85 HRH2 (0.36) LMNAHRH2HRH1MEN1KMT2A
SCHEMBL14651718 0.82 HRH2 (0.38) HRH2HRH1MEN1KMT2AALDH1A1
SCHEMBL16062670 0.82 HRH2 (0.40) HRH2HRH1MEN1KMT2AALDH1A1
SCHEMBL6606038 0.80 HRH2 (0.54) LMNAHRH2HRH1MEN1KMT2A
SCHEMBL5421607 0.80 THRB (0.42) ALDH1A1SMN1; SMN2MAPTTHRBTHRA

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-8835492-B2 Temperature and pH sensitive block copolymer and polymeric hydrogels using the same SUNGYUNKWAN UNIVERSITY FOUNDATION FOR CORPORATE COLLABORATION (KR) 2014-09-16 — — US disclosed
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