SCHEMBL11536277

SCHEMBL11536277

COCCCN(Cn1cnc2ccccc21)Cn1cnc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 10/20 0.49
▸ LMNA P02545 7/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ TSHR P16473 2/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ HTT P42858 6/20 0.47
▸ MAPT P10636 3/20 0.47
▸ STAT3 P40763 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ RAB9A P51151 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ CYP11B1 P15538 4/20 0.44
▸ CYP11B2 P19099 4/20 0.44
▸ TNF P01375 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL11543374 0.81 TDP1 (0.53) SMN1; SMN2LMNATDP1TSHRALOX15
SCHEMBL741950 0.81 SMN1; SMN2 (0.66) SMN1; SMN2LMNATDP1TSHRALOX15
SCHEMBL3002573 0.80 TDP1 (0.68) SMN1; SMN2LMNATDP1TSHRHTT
SCHEMBL19911315 0.79 TDP1 (0.50) SMN1; SMN2LMNATDP1TSHRALOX15
SCHEMBL1024585 0.77 SMN1; SMN2 (0.73) SMN1; SMN2LMNATDP1TSHRALOX15
SCHEMBL11543707 0.75 SLC9A1 (0.50) SMN1; SMN2LMNAL3MBTL1MEN1KMT2A
SCHEMBL2640498 0.74 TDP1 (0.63) SMN1; SMN2LMNATDP1TSHRALOX15
SCHEMBL28299452 0.74 SMN1; SMN2 (0.62) SMN1; SMN2LMNATDP1TSHRALOX15
SCHEMBL501944 0.72 SMN1; SMN2 (0.85) SMN1; SMN2LMNATDP1TSHRALOX15
SCHEMBL5374402 0.72 SMN1; SMN2 (0.85) SMN1; SMN2LMNATDP1TSHRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4177155-A N-AMINOMETHYL-TRIAZOLES AND IMIDAZOLES FOR MAKING ANTIFREEZES NONCORROSIVE CIBA-GEIGY CORPORATION (US) 1979-12-04 — — US disclosed
Send feedback