SCHEMBL8665933

SCHEMBL8665933

CON1C(=O)CCC(=O)[C@]1(C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N([N+]=O)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.37
CREBBP Q92793 1/20 0.37
KCNH2 Q12809 1/20 0.34
ELANE P08246 7/20 0.34
CYP2C9 P11712 4/20 0.34
CYP2C19 P33261 4/20 0.34
CYP3A4 P08684 4/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TACR1 P25103 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL8660922 0.92 ELANE (0.39) EP300CREBBPELANE
SCHEMBL5494650 0.85 ELANE (0.40) ELANE
SCHEMBL8663260 0.73 ELANE (0.32) ELANE
SCHEMBL847832 0.73 CMA1 (0.49)
SCHEMBL7410732 0.70 ELANE (0.43) ELANE
SCHEMBL10895690 0.70 ELANE (0.42) ELANEMEN1KMT2A
SCHEMBL2289363 0.69 ELANE (0.42) ELANE
SCHEMBL535732 0.69 ACE (0.40)
SCHEMBL230923 0.69 ELANE (0.33) KCNH2ELANECYP2C9CYP2C19CYP3A4
SCHEMBL5062693 0.68 TACR1 (0.43) TACR1

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-5776780-A AUTOMATIC ANALYZING; COLORIMETRIC PHOTOMETRY CHIMERA RESEARCH & CHEMICAL, INC. (US) 1998-07-07 US claimed