SCHEMBL7774642

SCHEMBL7774642

CCCCNc1nc(NCCCC)nc(N2CCCCC2)n1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.73
MEN1 O00255 2/20 0.73
KMT2A Q03164 2/20 0.73
NPSR1 Q6W5P4 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
GBA1 P04062 11/20 0.57
MAPT P10636 1/20 0.57
POLB P06746 2/20 0.51
TSHR P16473 2/20 0.48
ALOX15 P16050 1/20 0.47
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
TP53 P04637 1/20 0.46

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
SCHEMBL9913727 0.98 LMNA (0.75) LMNAMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL8050942 0.94 LMNA (0.69) LMNAMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL7774828 0.91 LMNA (0.65) LMNAMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL7776363 0.85 LMNA (0.57) LMNAMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL8054058 0.84 TSHR (0.68) LMNAMEN1KMT2ASMN1; SMN2GBA1
SCHEMBL9913722 0.84 KMT2A (0.55) LMNAMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL18404464 0.83 LMNA (0.55) LMNAMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL8611070 0.82 MEN1 (0.79) LMNAMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL4132657 0.82 LMNA (0.76) LMNAMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL9913749 0.81 LMNA (0.49) LMNAMEN1KMT2ANPSR1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882720-B1 METHODS FOR MODIFYING 1,3,5-TRIAZINE DERIVATIVES NISSAN CHEMICAL IND LTD (JP) 2001-08-22 EP disclosed
US-6127538-A HYDROXYALKYLATION OF A TRIAMINO TRIAZINE DERIVATIVE HAVING AT LEAST ONE REACTIVE NITROGEN BY REACTING WHILE HEATING WITH AN ALKANEDIOL OR ITS ADDUCT IN THE PRESENCE OF HYDROGEN AND A METAL CATALYST; BY-PRODUCT INHIBITION NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2000-10-03 US disclosed
US-6124381-A CURING ACCELERATOR IS A 2-((MONO- OR DI-ALKYL)AMINO, MORPHOLINO, PIPERIDINO, METHYL OR PHENYL)-4,6-SUBSTITUTED DIAMINO-1,3,5-TRIAZINE OF GIVEN FORMULA; POT LIFE, STORAGE STABILITY, AND WORKABILITY NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-26 US disclosed
EP-0882720-A1 METHODS FOR MODIFYING 1,3,5-TRIAZINE DERIVATIVES NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-12-09 EP disclosed
EP-0834523-A1 EPOXY/ACID ANHYDRIDE COMPOSITION NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-04-08 EP disclosed