SCHEMBL7829002

SCHEMBL7829002

Cc1oc2c(NC(=O)c3c(Cl)cccc3Cl)cc(C(=O)N3CCOCC3)cc2c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.48
HPGD P15428 2/20 0.46
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
KMT2A Q03164 2/20 0.44
PDK1 Q15118 1/20 0.43
PDK2 Q15119 1/20 0.43
PDK3 Q15120 1/20 0.43
PDK4 Q16654 1/20 0.43
TSHR P16473 1/20 0.42
MAPK13 O15264 1/20 0.42
MAPK12 P53778 1/20 0.42
MAPK11 Q15759 1/20 0.42
MAPK14 Q16539 1/20 0.42
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL7827650 0.90 HRH4 (0.41) HPGDKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL8341651 0.85 RAB9A (0.45) RAB9AHPGDCNR1CNR2KMT2A
SCHEMBL7816712 0.82 KMT2A (0.44) RAB9AKMT2AALDH1A1MAPT
SCHEMBL8339795 0.81 MAPK14 (0.43) RAB9AKMT2AMAPK11MAPK14SMN1; SMN2
SCHEMBL7824577 0.78 MAPT (0.47) RAB9AHPGDKMT2ATSHRNPC1
SCHEMBL7823933 0.76 MAPT (0.48) RAB9AKMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL7827224 0.76 KDM4E (0.49) RAB9ACNR1CNR2KMT2ATSHR
SCHEMBL8800003 0.76 ALDH1A1 (0.41) CNR1CNR2KMT2ATSHRALDH1A1
Hydrochloric Acid SCHEMBL7829506 0.76 RAB9A (0.44) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL7829184 0.75 SMN1; SMN2 (0.47) RAB9AHPGDKMT2ATSHRSMN1; SMN2

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
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
WO-1995029907-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-09 WO disclosed