SCHEMBL9759959

SCHEMBL9759959

CCCCN(C(C)=O)C1CC(C)(C)N(c2nc(Cl)nc(Cl)n2)C(C)(C)C1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
PTBP1 P26599 1/20 0.34
THRB P10828 1/20 0.31
PYGL P06737 1/20 0.30

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
SCHEMBL27292992 0.88 ALDH1A1 (0.33) SRD5A1ALDH1A1LMNAPTBP1THRB
SCHEMBL308455 0.76 SRD5A1 (0.38) SRD5A1ALDH1A1LMNAPTBP1THRB
SCHEMBL8459911 0.72 SRD5A1 (0.38) SRD5A1ALDH1A1LMNAPTBP1THRB
SCHEMBL6934625 0.69
SCHEMBL4417247 0.69 L3MBTL1 (0.35) SRD5A1ALDH1A1LMNAPTBP1THRB
SCHEMBL11140293 0.69 SRD5A1 (0.34) SRD5A1THRB
SCHEMBL6032698 0.69 TSHR (0.35)
SCHEMBL14224276 0.68 SRD5A1 (0.34) SRD5A1THRB
SCHEMBL1138443 0.68 SRD5A1 (0.34) SRD5A1THRB
SCHEMBL11770127 0.68

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-5059689-A Stabilizers against damage by light, oxygen, heat CIBA-GEIGY CORPORATION (US) 1991-10-22 US disclosed