SCHEMBL6725147

SCHEMBL6725147

O=C(O)c1cc(Cl)c(OCc2ccc(Cl)cc2)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.62
MRGPRX4 Q96LA9 6/20 0.60
PLAU P00749 1/20 0.55
RXRA P19793 2/20 0.52
RXRB P28702 2/20 0.52
RXRG P48443 1/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
RHEB Q15382 2/20 0.51
PPARA Q07869 1/20 0.49
HDAC8 Q9BY41 1/20 0.49

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
SCHEMBL1457712 0.89 MEN1 (0.63) NR4A2MRGPRX4PLAURXRARXRB
SCHEMBL11349380 0.87 MRGPRX4 (0.68) NR4A2MRGPRX4RXRARXRBRXRG
SCHEMBL8506243 0.84 TDP1 (0.52) NR4A2MRGPRX4MAPTHDAC8
SCHEMBL6731785 0.84 NR4A2 (0.59) NR4A2MRGPRX4RXRARXRBRXRG
SCHEMBL6723656 0.84 RXRA (0.64) NR4A2MRGPRX4PLAURXRARXRB
SCHEMBL12433155 0.82 MRGPRX4 (0.73) NR4A2MRGPRX4RXRAMAPTRAB9A
SCHEMBL6725152 0.81 MRGPRX4 (0.55) NR4A2MRGPRX4MAPTSMN1; SMN2RHEB
SCHEMBL8408730 0.81 MAPT (0.51) NR4A2MRGPRX4MAPTRHEBHDAC8
SCHEMBL5177240 0.79 NR4A2 (0.71) NR4A2MRGPRX4RXRARXRBRXRG
SCHEMBL2559495 0.79 ALDH1A1 (0.57) NR4A2MRGPRX4RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO claimed
US-6677473-B1 TREATMENT, PREVENTION OR AMELIORATION OF ONE OR MORE SYMPTOMS OF THROMBOTIC DISORDERS, UNSTABLE ANGINA OR CANCER CORVAS INTERNATIONAL INC 2004-01-13 US disclosed
WO-2003009871-A2 INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR FOR DECREASING BODY MASS GENSET S.A. (FR) 2003-02-06 WO disclosed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO disclosed
US-5866610-A Substituted benzoylguanidines, process for their preparation, their use as a pharmaceutical as inhibitors of the cellular NA+/H+ exchange or as a diagnostic, and pharmaceutical containing them HOECHST AKTIENGESELLSCHAFT (DE) 1999-02-02 US disclosed
EP-0612723-B1 Substituted benzoylguanidines, process for their preparation, their use as medicament, as inhibitor of the cellular Na+/H+ exchange or as diagnostic agent and medicament containing them HOECHST AG (DE) 1997-08-27 EP disclosed
EP-0612723-A1 Substituted benzoylguanidines, process for their preparation, their use as medicament, as inhibitor of the cellular Na+/H+ exchange or as diagnostic agent and medicament containing them HOECHST AKTIENGESELLSCHAFT (DE) 1994-08-31 EP disclosed