SCHEMBL7067047

SCHEMBL7067047

CCCCCCCCCCCCCCCCCCNC(=O)c1cc(C(N)=O)cc(C(=O)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NTRK2 Q16620 1/20 0.56
NAAA Q02083 4/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CA2 P00918 1/20 0.46
MLYCD O95822 1/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
GPR84 Q9NQS5 1/20 0.40
KDM5A P29375 1/20 0.40

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
SCHEMBL17688583 1.00 NTRK2 (0.56) NTRK2NAAAL3MBTL1THRATHRB
SCHEMBL10863404 0.88 NAAA (0.61) NAAAL3MBTL1THRATHRBSMN1; SMN2
SCHEMBL6536714 0.88 NAAA (0.61) NAAAL3MBTL1THRATHRBSMN1; SMN2
SCHEMBL2588584 0.82 SMN1; SMN2 (0.67) NAAAL3MBTL1SMN1; SMN2CA2MLYCD
SCHEMBL9979317 0.80 NAAA (0.71) NAAAL3MBTL1THRATHRBSMN1; SMN2
SCHEMBL9979011 0.80 NAAA (0.71) NAAAL3MBTL1THRATHRBSMN1; SMN2
SCHEMBL19326796 0.80 NAAA (0.71) NAAAL3MBTL1THRATHRBSMN1; SMN2
SCHEMBL1978767 0.80 NAAA (0.71) NAAAL3MBTL1THRATHRBSMN1; SMN2
SCHEMBL6437809 0.80 NAAA (0.71) NAAAL3MBTL1THRATHRBSMN1; SMN2
SCHEMBL9978782 0.80 NAAA (0.71) NAAAL3MBTL1THRATHRBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003037279-A1 USE OF A POLYMER WITH HYDROPHOBIC GROUPS AS A THICKENING OR GELLING AGENT, A COMPOSITION CONTAINING SAME AND THE ASSOCIATED GELATION METHOD L'OREAL (FR) 2003-05-08 WO claimed
EP-1179032-A1 NUCLEATORS FOR CRYSTALLIZABLE THERMOPLASTIC POLYMERS Ciba SC Holding AG (CH) 2002-02-13 EP disclosed
WO-2000052089-A1 NUCLEATORS FOR CRYSTALLIZABLE THERMOPLASTIC POLYMERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-09-08 WO disclosed