SCHEMBL3670914

SCHEMBL3670914

CCCCNC(=O)C1(NC(=O)OC)N=c2ccccc2=N1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.43
TSHR P16473 2/20 0.43
ALDH1A1 P00352 2/20 0.42
EPHX1 P07099 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
GAA P10253 1/20 0.38
POLB P06746 1/20 0.38
NAAA Q02083 1/20 0.38
NCEH1 Q6PIU2 1/20 0.38

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
SCHEMBL3706438 0.86 HTT (0.45) HTTTSHRALDH1A1EPHX1SMN1; SMN2
SCHEMBL6369850 0.75 SMN1; SMN2 (0.38) HTTTSHRALDH1A1EPHX1SMN1; SMN2
SCHEMBL8581599 0.71 HTT (0.43) HTTTSHRALDH1A1EPHX1SMN1; SMN2
SCHEMBL20456892 0.69 HTT (0.36) HTTTSHRALDH1A1SMN1; SMN2HPGD
SCHEMBL4364129 0.69 HPGD (0.36) HTTTSHRALDH1A1SMN1; SMN2HPGD
SCHEMBL27315325 0.68 HPGD (0.44) HTTTSHRALDH1A1SMN1; SMN2HPGD
SCHEMBL514302 0.65
SCHEMBL6689571 0.64 LMNA (0.35) HTTTSHRALDH1A1SMN1; SMN2HPGD
SCHEMBL14841947 0.64 HTT (0.51) HTTTSHRALDH1A1EPHX1SMN1; SMN2
Ammonia Solution, Strong SCHEMBL28983308 0.64 EPHX1 (0.79) EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2197960-A2 ANTIFOULING COATING Taimeitech Co., Ltd. (JP) 2010-06-23 EP disclosed
WO-2009047955-A2 ANTIFOULING COATING TAIMEITECH CO., LTD. (JP) 2009-04-16 WO disclosed