SCHEMBL25877375

SCHEMBL25877375

O=C(c1cccc(-c2nc3ccccc3[nH]2)n1)N1CCC2(CC1)CCN(C(=O)c1cccc(-c3nc4ccccc4[nH]3)n1)CC2

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LANCL2 Q9NS86 1/20 0.86
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HRH4 Q9H3N8 1/20 0.45
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
HPGD P15428 4/20 0.44
KDM4E B2RXH2 4/20 0.44
PKM P14618 3/20 0.44
ALDH1A1 P00352 3/20 0.44
TP53 P04637 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
LMNA P02545 1/20 0.44
MTOR P42345 1/20 0.44
METAP2 P50579 1/20 0.44
METAP1 P53582 1/20 0.44
ATR Q13535 3/20 0.42

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
SCHEMBL29466338 1.00 LANCL2 (0.86) LANCL2MEN1KMT2AHRH4RAB9A
SCHEMBL25312093 0.96 LANCL2 (0.79) LANCL2MEN1KMT2AHRH4RAB9A
SCHEMBL29466288 0.96 LANCL2 (0.79) LANCL2MEN1KMT2AHRH4ATR
SCHEMBL25314181 0.96 LANCL2 (0.79) LANCL2MEN1KMT2AHRH4ATR
Omilancor SCHEMBL17706588 0.93 LANCL2 (1.00) LANCL2MEN1KMT2AHRH4RAB9A
Omilancor SCHEMBL29349469 0.93 LANCL2 (1.00) LANCL2MEN1KMT2AHRH4RAB9A
SCHEMBL17705594 0.89 LANCL2 (0.88) LANCL2MEN1KMT2AHRH4RAB9A
SCHEMBL18805072 0.89 LANCL2 (0.88) LANCL2MEN1KMT2AHRH4RAB9A
SCHEMBL21043129 0.89 LANCL2 (0.93) LANCL2MEN1KMT2AHRH4RAB9A
SCHEMBL29063415 0.87 LANCL2 (0.84) LANCL2MEN1KMT2AHRH4RAB9A

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
EP-4215526-A1 CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF Shanghai Pharmaceuticals Holding Co., Ltd. (CN) 2023-07-26 EP disclosed