SCHEMBL24595487

SCHEMBL24595487

C=C(c1ccccc1)c1ccc(CP)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 3/20 0.41
HTT P42858 1/20 0.41
GFER P55789 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
CES1 P23141 3/20 0.39
CES2 O00748 2/20 0.39
SNCA P37840 2/20 0.37
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
PLA2G10 O15496 1/20 0.35
PLA2G2A P14555 1/20 0.35
LMNA P02545 1/20 0.35
GRM2 Q14416 1/20 0.35
HDAC1 Q13547 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL8733948 0.82 MEN1 (0.52) MEN1KMT2AMAPTHTTGFER
SCHEMBL894135 0.81 MEN1 (0.65) MEN1KMT2AMAPTHTTGFER
SCHEMBL9806373 0.80 HDAC1 (0.52) MEN1KMT2AMAPTHTTGFER
SCHEMBL9806315 0.80 LMNA (0.55) MEN1KMT2AMAPTHTTGFER
SCHEMBL6546186 0.78 TP53 (0.54) MEN1KMT2AMAPTHTTGFER
SCHEMBL8728904 0.78 HDAC1 (0.50) MEN1KMT2AMAPTMAOAMAOB
SCHEMBL8983371 0.78 CES2 (0.64) MEN1KMT2AMAPTHTTGFER
SCHEMBL3601470 0.78 KMT2A (0.48) MEN1KMT2AMAPTHTTGFER
SCHEMBL10889124 0.78 IDO1 (0.54) MEN1KMT2AMAPTHTTGFER
SCHEMBL3844822 0.78 MEN1 (0.61) MEN1KMT2AMAPTHTTGFER

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-3581213-B1 COATED MEDICAL DEVICE SURMODICS INC (US) 2022-07-06 EP disclosed