SCHEMBL6948263

SCHEMBL6948263

CCCCCCCc1cnc(-c2ccc(OCCCC)cc2)nc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.65
RAB9A P51151 7/20 0.65
NPC1 O15118 5/20 0.65
SMN1; SMN2 Q16637 5/20 0.65
KDM4E B2RXH2 5/20 0.65
HSD17B10 Q99714 2/20 0.65
ALDH1A1 P00352 5/20 0.61
MAPT P10636 4/20 0.61
HPGD P15428 3/20 0.61
MEN1 O00255 2/20 0.61
USP2 O75604 2/20 0.61
KMT2A Q03164 2/20 0.61
GAA P10253 1/20 0.61
L3MBTL1 Q9Y468 2/20 0.57
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
CYP3A4 P08684 3/20 0.51
LMNA P02545 1/20 0.51

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
SCHEMBL14295767 1.00 RARB (0.65) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL9268500 1.00 RARB (0.65) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL13029249 0.98 RARB (0.63) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL2774683 0.98 RARB (0.63) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL9636338 0.98 RARB (0.63) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL10342131 0.98 RARB (0.63) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL7910730 0.98 RARB (0.63) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL9436035 0.98 RARB (0.63) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL7121080 0.98 RARB (0.63) RARBRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL9241350 0.98 RARB (0.63) RARBRAB9ANPC1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0639189-B1 PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES AVENTIS RES & TECH GMBH & CO (DE) 2003-02-19 EP disclosed
EP-0532916-B1 2-Fluoropyrazines, process for their preparation, and their use in liquid crystalline mixtures HOECHST AG (DE) 1997-11-05 EP disclosed
US-5562859-A SWITCHING AND DISPLAY DEVICE HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-08 US disclosed
US-5443754-A Pyridylpyrimidines, a process for their preparation and their use in liquid-crystalline mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-22 US disclosed
EP-0532916-A1 2-Fluoropyrazines, process for their preparation, and their use in liquid crystalline mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-24 EP disclosed