SCHEMBL6983743

SCHEMBL6983743

Nc1nc(N)nc(-c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)n1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
SCN9A Q15858 13/20 0.54
LMNA P02545 1/20 0.54
THRB P10828 1/20 0.53
FPR2 P25090 2/20 0.53
RAB9A P51151 1/20 0.48

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
SCHEMBL15992851 0.87 SCN9A (0.69) MAPTNPSR1SCN9ALMNAFPR2
SCHEMBL11351938 0.82 MAPT (0.69) MAPTNPSR1LMNATHRBRAB9A
SCHEMBL4728325 0.81 KDM4E (0.62) MAPTNPSR1LMNATHRBRAB9A
SCHEMBL19072372 0.79 SCN9A (0.71) SCN9ALMNAFPR2
SCHEMBL30006227 0.77 LMNA (0.53) MAPTNPSR1SCN9ALMNATHRB
SCHEMBL27638920 0.77 NPC1 (0.66) MAPTLMNATHRBRAB9A
SCHEMBL22607453 0.75 SCN9A (0.72) SCN9AFPR2
SCHEMBL906222 0.75 LMNA (0.63) MAPTNPSR1SCN9ALMNATHRB
SCHEMBL11383589 0.75 LIPE (0.65) MAPTNPSR1LMNATHRBRAB9A
SCHEMBL21652204 0.75 RAB9A (0.67) MAPTNPSR1LMNATHRBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1037886-B1 TRIAZINE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2003-05-02 EP claimed
US-6150362-A ADMINISTERING 1,3,5-SUBSTITUTED TRIAZINE COMPOUNDS TO THE PATIENT SUFFERING FROM ANGIOGENIC DISEASES ABBVIE INC. 2000-11-21 US claimed
EP-1037886-A1 TRIAZINE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2000-09-27 EP claimed
WO-1999031088-A1 TRIAZINE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 1999-06-24 WO claimed
EP-1037886-B1 TRIAZINE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2003-05-02 EP disclosed
US-6288228-B1 DIAMINOTRIAZINE DERIVATIVES ABBOTT LABORATORIES 2001-09-11 US disclosed
US-6150362-A ADMINISTERING 1,3,5-SUBSTITUTED TRIAZINE COMPOUNDS TO THE PATIENT SUFFERING FROM ANGIOGENIC DISEASES ABBVIE INC. 2000-11-21 US disclosed
EP-1037886-A1 TRIAZINE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2000-09-27 EP disclosed
WO-1999031088-A1 TRIAZINE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 1999-06-24 WO disclosed