SCHEMBL7316756

SCHEMBL7316756

Nc1nnc(-c2ccc(N3CCOCC3)cc2)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
MGAM O43451 4/20 0.51
GAA P10253 4/20 0.51
SI P14410 4/20 0.51
MGAM2 Q2M2H8 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 1/20 0.51
NOTUM Q6P988 1/20 0.51
LGMN Q99538 2/20 0.51
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
MAPT P10636 3/20 0.50
TP53 P04637 2/20 0.50
ALOX15 P16050 1/20 0.50
PIM1 P11309 5/20 0.49
PIM3 Q86V86 5/20 0.49
PIM2 Q9P1W9 5/20 0.49
HPGD P15428 2/20 0.49
HSD17B10 Q99714 2/20 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
SCHEMBL8160141 0.87 KDM4E (0.54) KDM4EMGAMGAASIMGAM2
SCHEMBL7325194 0.86 GAA (0.53) KDM4EMGAMGAASIMGAM2
SCHEMBL7312437 0.84 KDM4E (0.51) KDM4EMGAMGAASIMGAM2
SCHEMBL8144038 0.78 KDM4E (0.47) KDM4EMGAMGAASIMGAM2
SCHEMBL15545836 0.77 HDAC3 (0.55) SMN1; SMN2LGMNNPC1RAB9AMAPT
SCHEMBL7324945 0.77 ALDH1A1 (0.50) KDM4EMGAMGAASIMGAM2
SCHEMBL7324936 0.77 ALDH1A1 (0.50) KDM4EMGAMGAASIMGAM2
SCHEMBL6132879 0.76 KDM4E (0.43) KDM4EMGAMGAASIMGAM2
SCHEMBL21474442 0.75 PIK3CA (0.66)
SCHEMBL7316750 0.75 KDM4E (0.50) KDM4EMGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119661470-A Thiadiazole urea compound or pharmaceutically acceptable salt thereof, pharmaceutical composition and application thereof 安徽医科大学 2025-03-21 CN disclosed
US-6232290-B1 FUNGICIDES AGAINST PNEUMOCYSTIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-15 US disclosed