SCHEMBL8557772

SCHEMBL8557772

CCCc1[nH]c2cc(C(=O)OC)ccc2c1Cc1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
ATM Q13315 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
KIF11 P52732 1/20 0.49
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
PARP1 P09874 1/20 0.46
NPC1 O15118 1/20 0.45
PPARG P37231 1/20 0.45
ALOX5 P09917 1/20 0.45
PTGS2 P35354 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 1/20 0.44
GPR84 Q9NQS5 1/20 0.43
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CHRNB2 P17787 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40

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
SCHEMBL5797940 0.88 PPARG (0.49) MEN1KMT2AATML3MBTL1PARP1
SCHEMBL5881925 0.80 MEN1 (0.69) MEN1KMT2AATML3MBTL1KIF11
SCHEMBL8551585 0.78 SMN1; SMN2 (0.48) MEN1KMT2AATML3MBTL1KIF11
SCHEMBL8555588 0.78 SMN1; SMN2 (0.47) MEN1KMT2AATML3MBTL1KIF11
SCHEMBL8554409 0.77 LMNA (0.47) MEN1KMT2AATML3MBTL1KIF11
SCHEMBL7710530 0.77 ALOX5 (0.47) MEN1KMT2AATML3MBTL1KIF11
SCHEMBL7418378 0.76 KMT2A (0.62) MEN1KMT2AATML3MBTL1KIF11
SCHEMBL5882184 0.76 PDE3B (0.56) MEN1KMT2AATML3MBTL1KIF11
SCHEMBL7418110 0.76 KMT2A (0.58) MEN1KMT2AATML3MBTL1KIF11
SCHEMBL16880361 0.76 MEN1 (0.61) MEN1KMT2AATML3MBTL1KIF11

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