SCHEMBL8551666

SCHEMBL8551666

CCCc1[nH]c2cc(C(=O)NCc3cc4c(cc3Cl)OCO4)ccc2c1C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.45
HPGD P15428 3/20 0.45
HTT P42858 2/20 0.45
HSD17B10 Q99714 2/20 0.45
MAPT P10636 2/20 0.45
ESR1 P03372 1/20 0.42
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.41
ROCK2 O75116 2/20 0.40
GAA P10253 2/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 3/20 0.40
CYP2D6 P10635 3/20 0.40
CYP2C19 P33261 3/20 0.40
CYP2C9 P11712 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39

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
SCHEMBL7707825 0.84 ROCK2 (0.57) KDM4EHTTMAPTALDH1A1ROCK2
SCHEMBL8554376 0.76 ROCK2 (0.56) KDM4EMAPTROCK2LMNASMN1; SMN2
SCHEMBL7701986 0.75 ROCK2 (0.54) KDM4EHTTMAPTALDH1A1ROCK2
SCHEMBL18073895 0.75 ROCK2 (0.56) KDM4EMAPTALDH1A1ROCK2LMNA
SCHEMBL8556812 0.73 ROCK2 (0.60) KDM4EMAPTALDH1A1ROCK2LMNA
SCHEMBL27483791 0.72 KDM4E (0.46) KDM4EHPGDHSD17B10KMT2AALDH1A1
SCHEMBL8556446 0.72 SCD (0.41) KDM4EHPGDHTTHSD17B10MAPT
SCHEMBL7423432 0.71 KMT2A (0.62) KDM4EHPGDHTTHSD17B10KMT2A
SCHEMBL27528020 0.71 CYP1A2 (0.43) KDM4EHSD17B10KMT2AALDH1A1MEN1
SCHEMBL8555167 0.70 ROCK2 (0.63) KDM4EHTTMAPTALDH1A1ROCK2

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-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed