SCHEMBL14941124

SCHEMBL14941124

CC(O)N(CCO)c1ccnc2c(N)cnn12

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 1/20 0.31
GPR119 Q8TDV5 1/20 0.30
ADA P00813 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
SCHEMBL127655 0.81 SMPD3 (0.35) SMPD3
SCHEMBL6541773 0.78 GPR119 (0.30) GPR119
SCHEMBL7806647 0.72
SCHEMBL7806646 0.72 SMPD3 (0.31) SMPD3
SCHEMBL3224680 0.68 SMPD3 (0.35) SMPD3GPR119ADA
SCHEMBL7452366 0.66
SCHEMBL7455976 0.65 SMPD3 (0.43) SMPD3
SCHEMBL127121 0.65 SMPD3 (0.43) SMPD3
SCHEMBL5793336 0.65 LMNA (0.32)
SCHEMBL125976 0.65 SMPD3 (0.50) SMPD3

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-2775992-A1 COMPOSITIONS AND METHODS FOR ALTERING THE APPEARANCE OF HAIR L'Oréal (FR) 2014-09-17 EP disclosed
WO-2013071194-A1 COMPOSITIONS AND METHODS FOR ALTERING THE APPEARANCE OF HAIR L'OREAL (FR) 2013-05-16 WO disclosed