SCHEMBL7828822

SCHEMBL7828822

Cc1oc2c(C(=O)Nc3c(C(C)C)cccc3C(C)C)cccc2c1C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.43
S1PR4 O95977 1/20 0.41
S1PR5 Q9H228 1/20 0.41
KCNK3 O14649 2/20 0.41
KCNK9 Q9NPC2 2/20 0.41
MEN1 O00255 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NLRP3 Q96P20 2/20 0.40
RIPK1 Q13546 1/20 0.38
AKR1C3 P42330 1/20 0.38

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
SCHEMBL7823701 0.82 MEN1 (0.43) KMT2ASMN1; SMN2MEN1
SCHEMBL7826676 0.82 POLB (0.57) KMT2ALMNASMN1; SMN2MEN1
SCHEMBL7815903 0.81 SMN1; SMN2 (0.49) KMT2ALMNASMN1; SMN2MEN1
SCHEMBL7830797 0.79 MAOB (0.52) KMT2ASMN1; SMN2S1PR4MEN1
SCHEMBL8341821 0.79 POLB (0.47) KMT2ALMNASMN1; SMN2S1PR4S1PR5
SCHEMBL8346730 0.78 POLB (0.49) KMT2ALMNASMN1; SMN2MEN1AKR1C3
SCHEMBL5187435 0.77 KMT2A (0.72) KMT2ALMNASMN1; SMN2KCNK3KCNK9
SCHEMBL8345366 0.77 POLB (0.45) KMT2ALMNAMEN1AKR1C3
SCHEMBL7827806 0.77 S1PR2 (0.46) KMT2ALMNASMN1; SMN2S1PR4S1PR5
SCHEMBL7824410 0.75 KCNMA1 (0.62) KMT2ALMNASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757682-B1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO (JP) 2001-06-20 EP disclosed
US-5858995-A ADMINISTERING TO HUMANS AND ANIMALS IN THE TREATMENT OF DISEASES CAUSED BY ABNORMAL BONE METABOLISM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0757682-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed
WO-1995029907-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-09 WO disclosed