SCHEMBL9037446

SCHEMBL9037446

Cc1cc2ncn(CCCCl)c2cc1C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.76
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
MAPT P10636 4/20 0.61
TP53 P04637 1/20 0.61
HTT P42858 1/20 0.61
POLB P06746 3/20 0.58
KCNH2 Q12809 1/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
ALDH1A1 P00352 2/20 0.52
P2RX7 Q99572 1/20 0.51
GGPS1 O95749 1/20 0.50
FDPS P14324 1/20 0.50
FABP6 P51161 1/20 0.49
USP2 O75604 1/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.46
PLAA Q9Y263 1/20 0.45
ALPG P10696 1/20 0.44

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
SCHEMBL1524043 0.91 LMNA (0.68) LMNAMEN1KMT2AMAPTTP53
SCHEMBL19911300 0.86 LMNA (1.00) LMNAMEN1KMT2AMAPTTP53
SCHEMBL9128979 0.85 LMNA (0.73) LMNAMEN1KMT2AMAPTTP53
SCHEMBL19911323 0.84 POLB (0.69) LMNAMEN1KMT2AMAPTTP53
SCHEMBL9128299 0.83 LMNA (0.71) LMNAMEN1KMT2AMAPTTP53
SCHEMBL8088089 0.83 LMNA (0.71) LMNAMEN1KMT2AMAPTTP53
SCHEMBL15779866 0.82 LMNA (0.81) LMNAMEN1KMT2AMAPTTP53
SCHEMBL9123166 0.82 LMNA (0.69) LMNAMEN1KMT2AMAPTTP53
SCHEMBL29097793 0.81 LMNA (0.68) LMNAMEN1KMT2AMAPTTP53
SCHEMBL9040262 0.81 PRPS1 (0.52) LMNAMEN1KMT2AMAPTTP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0393574-B1 Hexitol derivatives KYOWA HAKKO KOGYO KK (JP) 1996-01-31 EP disclosed
US-5053408-A Cardiovascular disorders KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-10-01 US disclosed
EP-0393574-A2 Hexitol derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-10-24 EP disclosed