SCHEMBL24445558

SCHEMBL24445558

COC(=O)CNc1cccc(C(C)=O)c1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
ALDH1A1 P00352 6/20 0.52
RAB9A P51151 3/20 0.52
HPGD P15428 2/20 0.52
MAPK1 P28482 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
NPC1 O15118 1/20 0.52
TDP1 Q9NUW8 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MAPT P10636 2/20 0.50
AKR1C3 P42330 1/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
POLB P06746 1/20 0.50
GFER P55789 1/20 0.50
TP53 P04637 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49

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
SCHEMBL29613642 1.00 MEN1 (0.53) MEN1KMT2AALDH1A1RAB9AHPGD
SCHEMBL134016 0.87 EGFR (0.57) MEN1KMT2AALDH1A1RAB9AHPGD
SCHEMBL11283115 0.86 PARP1 (0.52) MEN1KMT2AALDH1A1AKR1C3
SCHEMBL15057284 0.85 HPGD (0.48) MEN1KMT2AALDH1A1RAB9AHPGD
SCHEMBL28126809 0.84 POLB (0.57) MEN1KMT2AALDH1A1RAB9AMAPK1
SCHEMBL6904254 0.80 ALDH1A1 (0.51) MEN1KMT2AALDH1A1RAB9AHPGD
SCHEMBL9779996 0.80 MAPT (0.56) MEN1KMT2AALDH1A1RAB9AHPGD
SCHEMBL8285571 0.80 KMT2A (0.59) MEN1KMT2AALDH1A1RAB9AHPGD
SCHEMBL9779970 0.79 GAA (0.53) MEN1KMT2AALDH1A1RAB9AHPGD
SCHEMBL1733736 0.79 GRK2 (0.47) MEN1KMT2AALDH1A1RAB9AMAPK1

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-4000609-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING BONE DISEASES Industry Foundation of Chonnam National University (KR) 2022-05-25 EP disclosed