SCHEMBL25897016

SCHEMBL25897016

c1ccc(-c2ccc(-c3ccc(-c4nc(-c5ccc(-c6nc7ccccc7s6)cc5)cc(-c5ccc(-c6nc7ccccc7s6)cc5)n4)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.59
▸ APP P05067 6/20 0.59
▸ KDM4E B2RXH2 6/20 0.59
▸ NPC1 O15118 5/20 0.59
▸ MAPT P10636 4/20 0.59
▸ MMP9 P14780 3/20 0.59
▸ MMP8 P22894 3/20 0.59
▸ LMNA P02545 3/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ GLA P06280 3/20 0.59
▸ GAA P10253 3/20 0.59
▸ MMP2 P08253 2/20 0.56
▸ MMP13 P45452 2/20 0.56
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ NFKB1 P19838 3/20 0.55
▸ NFKB2 Q00653 3/20 0.55
▸ RELA Q04206 3/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ PKM P14618 2/20 0.55

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
SCHEMBL25897450 1.00 RAB9A (0.59) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL25303434 1.00 RAB9A (0.59) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL31208337 1.00 RAB9A (0.59) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL24353063 0.98 RAB9A (0.61) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL25260659 0.95 APP (0.65) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL31208350 0.95 APP (0.65) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL9958225 0.94 RAB9A (0.56) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL27049375 0.93 RAB9A (0.58) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL25896394 0.92 RAB9A (0.51) RAB9AAPPKDM4ENPC1MAPT
SCHEMBL25896518 0.91 RAB9A (0.50) RAB9AAPPKDM4ENPC1MAPT

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-2023136295-A1 PYRIMIDINE COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT 保土谷化学工業株式会社 2023-07-20 — — WO disclosed
Send feedback