SCHEMBL9846284

SCHEMBL9846284

CCCCc1ccccc1Nc1nc2ccc(NCc3ccccc3)cc2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.50
RAB9A P51151 3/20 0.50
LMNA P02545 3/20 0.50
TP53 P04637 2/20 0.50
HTT P42858 2/20 0.50
HIF1A Q16665 2/20 0.50
GFER P55789 1/20 0.50
HDAC6 Q9UBN7 2/20 0.43
MMP9 P14780 1/20 0.43
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
TUBB4A P04350 4/20 0.41
TUBB P07437 4/20 0.41
TUBA3C P0DPH7 4/20 0.41
TUBA1B P68363 4/20 0.41
TUBA4A P68366 4/20 0.41
TUBB4B P68371 4/20 0.41
TUBB3 Q13509 4/20 0.41
TUBB2A Q13885 4/20 0.41

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
SCHEMBL9846281 0.92 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ALMNATP53HTT
SCHEMBL9368188 0.86 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ALMNATP53HTT
SCHEMBL9372321 0.83 SMN1; SMN2 (0.59) SMN1; SMN2RAB9ALMNATP53HTT
SCHEMBL9368584 0.80 RAB9A (0.60) SMN1; SMN2RAB9ALMNATP53HTT
SCHEMBL2932936 0.79 AKR1C3 (0.47) SMN1; SMN2RAB9ALMNAHTTHIF1A
SCHEMBL9368586 0.79 RAB9A (0.63) SMN1; SMN2RAB9ALMNATP53HTT
Hydrochloric Acid SCHEMBL9368917 0.79 RAB9A (0.59) SMN1; SMN2RAB9ALMNATP53HTT
Hydrochloric Acid SCHEMBL9373375 0.78 RAB9A (0.62) SMN1; SMN2RAB9ALMNATP53HTT
SCHEMBL9368175 0.78 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ALMNATP53HTT
SCHEMBL9372311 0.74 SMN1; SMN2 (0.50) SMN1; SMN2RAB9ALMNATP53HTT

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
EP-0419210-A1 Novel benzimidazole compounds and their use PFIZER INC. (US) 1991-03-27 EP claimed