SCHEMBL14102841

SCHEMBL14102841

CCCCCCCCCC(=O)N[C@H](C(=O)NCCCCCCCCCCC(=O)NCc1ccncc1)C(C)C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 3/20 0.51
▸ MAPT P10636 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ FAAH O00519 4/20 0.46
▸ GRIA1 P42261 1/20 0.46
▸ NAAA Q02083 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ TRPV1 Q8NER1 1/20 0.45
▸ NAMPT P43490 1/20 0.44
▸ CNR1 P21554 1/20 0.44
▸ CNR2 P34972 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HTR1A P08908 1/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ STS P08842 1/20 0.43

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
SCHEMBL14102595 0.89 EPHX2 (0.53) EPHX2MAPTLMNAMAPK1FAAH
SCHEMBL14102771 0.89 EPHX2 (0.53) EPHX2MAPTLMNAMAPK1FAAH
SCHEMBL14102636 0.85 EPHX2 (0.49) EPHX2MAPTLMNAMAPK1FAAH
SCHEMBL14102639 0.85 EPHX2 (0.49) EPHX2MAPTLMNAMAPK1FAAH
SCHEMBL14103239 0.85 EPHX2 (0.49) EPHX2MAPTLMNAMAPK1FAAH
SCHEMBL14102656 0.85 EPHX2 (0.65) EPHX2MAPTFAAHNAAAHTT
SCHEMBL14102602 0.84 CYP3A4 (0.57) —
SCHEMBL14102634 0.83 CAPN1 (0.49) EPHX2MAPTLMNAMAPK1FAAH
SCHEMBL14102643 0.82 EPHX2 (0.57) EPHX2FAAHNAAACNR1CNR2
SCHEMBL14102830 0.82 EPHX2 (0.57) EPHX2FAAHNAAACNR1CNR2

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-2008102127-A2 GEL FORMING COMPOUNDS PLIVA HRVATSKA D.O.O. (HR) 2008-08-28 — — WO disclosed
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