SCHEMBL8341865

SCHEMBL8341865

Cc1oc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2c1C(C)O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
RAB9A P51151 2/20 0.41
GPR35 Q9HC97 3/20 0.40
MAPT P10636 3/20 0.40
POLB P06746 1/20 0.39
ALDH1A1 P00352 3/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CRHBP P24387 1/20 0.38
HTT P42858 1/20 0.38
CRHR2 Q13324 1/20 0.38
GHSR Q92847 1/20 0.37

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
SCHEMBL8800035 0.87 GHSR (0.40) KMT2AMEN1RAB9AMAPTPOLB
SCHEMBL7817213 0.87 MEN1 (0.39) KMT2AMEN1RAB9AGPR35MAPT
SCHEMBL7827138 0.85 KMT2A (0.38) KMT2AMEN1RAB9AGPR35MAPT
SCHEMBL7816603 0.85 MEN1 (0.38) KMT2AMEN1RAB9AMAPTPOLB
SCHEMBL7823933 0.84 MAPT (0.48) KMT2AMEN1RAB9AGPR35MAPT
SCHEMBL7823424 0.83 TSHR (0.41) KMT2AMEN1RAB9AGPR35MAPT
SCHEMBL8800451 0.82 TYK2 (0.42) KMT2AMEN1MAPTALDH1A1TYK2
SCHEMBL7824655 0.81 KMT2A (0.44) KMT2AMEN1RAB9AGPR35MAPT
SCHEMBL7826306 0.81 GAA (0.45) KMT2AMEN1RAB9AGPR35MAPT
SCHEMBL8800255 0.81 ITGB1 (0.37) KMT2AMEN1RAB9AMAPTPOLB

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