SCHEMBL8050481

SCHEMBL8050481

CCCc1cnc(-c2ccc(-c3ccc(CC)cc3)cc2)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.49
SMN1; SMN2 Q16637 11/20 0.49
RAB9A P51151 11/20 0.49
MAPT P10636 5/20 0.49
HSD17B10 Q99714 4/20 0.49
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 4/20 0.49
HPGD P15428 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
USP2 O75604 1/20 0.49
GAA P10253 1/20 0.49
NPC1 O15118 10/20 0.46
TP53 P04637 5/20 0.46
METAP2 P50579 1/20 0.43
PKM P14618 1/20 0.41
THRB P10828 2/20 0.41
MITF O75030 1/20 0.38
KLF5 Q13887 1/20 0.38
NFKB1 P19838 2/20 0.38

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
SCHEMBL7910433 0.98 SMN1; SMN2 (0.50) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL8753870 0.91 RAB9A (0.54) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL7907395 0.90 RAB9A (0.57) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL8047105 0.89 RAB9A (0.58) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL10613205 0.89 RAB9A (0.66) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL8526877 0.88 TP53 (0.48) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL7914111 0.87 RAB9A (0.59) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL10501532 0.87 RAB9A (0.54) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL9638169 0.86 MAPT (0.68) RARBSMN1; SMN2RAB9AMAPTHSD17B10
SCHEMBL803074 0.86 TP53 (0.50) RARBSMN1; SMN2RAB9AMAPTHSD17B10

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-0700982-B1 A liquid crystal composition and a liquid crystal display element using the same CHISSO CORP (JP) 2000-04-26 EP disclosed
EP-0700982-A1 A liquid crystal composition and a liquid crystal display element using the same Chisso Corporation (JP) 1996-03-13 EP disclosed