SCHEMBL14908562

SCHEMBL14908562

CCOP(=O)(CC(=O)N(N)c1ccccn1)OCC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
GAA P10253 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
TP53 P04637 2/20 0.38
NPC1 O15118 2/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MITF O75030 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL27471455 0.74 POLB (0.43) TSHRGAASMN1; SMN2POLBMEN1
SCHEMBL12446562 0.71 GAA (0.58) GAASMN1; SMN2MEN1KMT2ATP53
SCHEMBL21588945 0.71 ALDH1A1 (0.47) TSHRGAASMN1; SMN2POLBMEN1
SCHEMBL6668547 0.70 TRPM8 (0.41) TSHRGAASMN1; SMN2POLBMEN1
SCHEMBL6668556 0.70 TRPM8 (0.41) TSHRGAASMN1; SMN2POLBMEN1
SCHEMBL19668416 0.69 TSHR (0.54) TSHRGAASMN1; SMN2POLBMEN1
SCHEMBL8668737 0.69 TSHR (0.46) TSHRSMN1; SMN2POLBMEN1KMT2A
SCHEMBL5361045 0.69 ALDH1A1 (0.43) GAASMN1; SMN2POLBMAPTCYP2C19
SCHEMBL7126888 0.69 MAPT (0.40) TSHRGAASMN1; SMN2POLBMEN1
SCHEMBL9080414 0.68 TSHR (0.45) TSHRSMN1; SMN2POLBMEN1KMT2A

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
WO-2013061052-A1 NOVEL DOSAGE FORM BIOTICA TECHNOLOGY LIMITED (GB) 2013-05-02 WO disclosed