SCHEMBL6428302

SCHEMBL6428302

CC(C)(c1ccncc1)c1ccncc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.50
ESR1 P03372 3/20 0.46
ESR2 Q92731 3/20 0.46
CYP3A4 P08684 2/20 0.46
TSHR P16473 2/20 0.46
AR P10275 1/20 0.46
HPGD P15428 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
HTR6 P50406 1/20 0.46
ESRRG P62508 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
CYP19A1 P11511 3/20 0.41
USP2 O75604 1/20 0.41
RAB9A P51151 1/20 0.41
CHRM5 P08912 1/20 0.39
CHKA P35790 1/20 0.39

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
SCHEMBL2815903 0.85 MAPT (0.52) KIF11ESR1ESR2CYP3A4TSHR
SCHEMBL27526789 0.84 KIF11 (0.52) KIF11CYP3A4TSHRLMNAMAPT
SCHEMBL19157934 0.82 SMN1; SMN2 (0.52) KIF11CYP3A4HPGDLMNAMAPT
SCHEMBL65312 0.81 KIF11 (0.71) KIF11TSHRHPGDLMNAMAPT
SCHEMBL820736 0.81 KIF11 (0.71) KIF11TSHRHPGDLMNAMAPT
Lithium SCHEMBL29576172 0.79 KIF11 (0.68) KIF11TSHRHPGDLMNAMAPT
SCHEMBL29245411 0.79 KIF11 (0.68) KIF11TSHRHPGDLMNAMAPT
SCHEMBL20137330 0.79 KIF11 (0.68) KIF11TSHRHPGDLMNAMAPT
SCHEMBL28443995 0.79 KIF11 (0.68) KIF11TSHRHPGDLMNAMAPT
Hydrochloric Acid SCHEMBL15140525 0.79 KIF11 (0.68) KIF11TSHRHPGDLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6921824-B1 Ruthenium dimeric complexes suitable as antimetastatic and antineoplastic agents SIGEA S.R.L. (IT) 2005-07-26 US claimed
EP-1185540-B1 RUTHENIUM DIMERIC COMPLEXES SUITABLE AS ANTIMETASTATIC AND ANTINEOPLASTIC AGENTS SIGEA SRL (IT) 2003-08-27 EP claimed
EP-1185540-A1 RUTHENIUM DIMERIC COMPLEXES SUITABLE AS ANTIMETASTATIC AND ANTINEOPLASTIC AGENTS Sigea S.r.l. (IT) 2002-03-13 EP claimed
WO-2000063218-A1 RUTHENIUM DIMERIC COMPLEXES SUITABLE AS ANTIMETASTATIC AND ANTINEOPLASTIC AGENTS SIGEA S.R.L. (IT) 2000-10-26 WO claimed
EP-1392707-A2 NEW ANIONIC AND NEUTRAL COMPLEXES OF RUTHENIUM (II) WITH NITROGEN OXIDE Sigea S.R.L. (IT) 2004-03-03 EP disclosed
WO-2002076998-A2 NEW ANIONIC AND NEUTRAL COMPLEXES OF RUTHENIUM (II) WITH NITROGEN OXIDE SIGEA S.R.L. (IT) 2002-10-03 WO disclosed