SCHEMBL8345228

SCHEMBL8345228

COCc1c(C)oc2c(NC(=O)c3c(Cl)cccc3Cl)cccc12

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGES O14684 6/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 1/20 0.43
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
CRHBP P24387 1/20 0.41
HTT P42858 1/20 0.41
CRHR2 Q13324 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GHSR Q92847 2/20 0.40
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
AKR1C3 P42330 1/20 0.38
SLC16A3 O15427 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
SCHEMBL7823605 0.89 KMT2A (0.41) MEN1KMT2APOLBRAB9ACRHBP
SCHEMBL7815783 0.87 MEN1 (0.44) MEN1KMT2APOLBRAB9ACRHBP
SCHEMBL7827815 0.87 MEN1 (0.44) MEN1KMT2APOLBRAB9ACRHBP
SCHEMBL7832320 0.87 MAPT (0.42) MEN1KMT2APOLBRAB9ACRHBP
SCHEMBL7823417 0.86 MEN1 (0.43) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL7816944 0.86 KMT2A (0.42) MEN1KMT2APOLBRAB9ACRHBP
SCHEMBL7816337 0.85 KDM4E (0.41) MEN1KMT2APOLBRAB9ACRHBP
SCHEMBL8342243 0.85 GHSR (0.39) MEN1KMT2APOLBRAB9ACRHBP
SCHEMBL7827960 0.85 ALDH1A1 (0.40) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL7831438 0.85 AKR1B1 (0.42) MEN1KMT2APOLBRAB9ACRHBP

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
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