SCHEMBL31478993

SCHEMBL31478993

CCN(C(=O)c1cc(F)ccc1-c1cc(N2CCN(C(=O)OC(C)(C)C)CC2)cn2c(C)ncc12)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
WNT3A P56704 2/20 0.37
RET P07949 1/20 0.36
GPR119 Q8TDV5 7/20 0.36
PIK3CA P42336 1/20 0.36
PDK2 Q15119 1/20 0.35
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL31479790 0.98 CKS1B (0.37) ENPP2MAPTMEN1KMT2ATSHR
SCHEMBL31479700 0.93 RET (0.37) ENPP2MAPTMEN1KMT2ATSHR
SCHEMBL31479143 0.92 MAPT (0.40) ENPP2MAPTMEN1KMT2ATSHR
SCHEMBL31479674 0.91 ENPP2 (0.37) ENPP2MAPTMEN1KMT2ATSHR
SCHEMBL31479681 0.91 MEN1 (0.35) MEN1KMT2ARETGPR119PIK3CA
SCHEMBL31479380 0.89 PREP (0.38) ENPP2MAPTMEN1KMT2ARET
SCHEMBL31479015 0.88 MAPT (0.38) MAPTMEN1KMT2ASMN1; SMN2GPR119
SCHEMBL31479366 0.87 ENPP2 (0.39) ENPP2MAPTMEN1KMT2ATSHR
SCHEMBL31479892 0.87 GPBAR1 (0.38) SMN1; SMN2GPR119NR1H2NR1H3
SCHEMBL31479517 0.86 SMN1; SMN2 (0.42) MAPTMEN1KMT2ATSHRSMN1; SMN2

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-2025067111-A1 MENIN-MLL INTERACTION INHIBITOR AND PREPARATION METHOD THEREFOR, AND APPLICATION 苏州必扬医药科技有限公司 2025-04-03 WO disclosed