SCHEMBL8485436

SCHEMBL8485436

[O]c1ccc(-n2cnnn2)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 4/20 0.66
NOTUM Q6P988 5/20 0.64
MAPT P10636 3/20 0.64
F2 P00734 1/20 0.64
ALDH1A1 P00352 3/20 0.58
LMNA P02545 1/20 0.58
HTT P42858 1/20 0.58
HPGD P15428 1/20 0.51
POLB P06746 1/20 0.51
BLM P54132 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL1663879 0.79 KCNJ1 (1.00) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL10738426 0.78 NOTUM (1.00) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL1163779 0.78 NOTUM (0.64) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL311636 0.78 MAPT (1.00) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL82595 0.78 MAPT (0.69) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL11716535 0.77 NOTUM (0.62) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL14919144 0.76 NOTUM (0.61) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL334399 0.76 KCNJ1 (1.00) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL3962509 0.76 NOTUM (0.95) KCNJ1NOTUMMAPTF2ALDH1A1
SCHEMBL7096356 0.76 NOTUM (0.95) KCNJ1NOTUMMAPTF2ALDH1A1

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-5877196-A N- 4-(imidazolyl or pyrazolyl)phenyl(oxy, sulfinyl, sulfenyl or sulfonyl)alkyl!carboxamides, sulfonamides or phosphoramides having antiarrhythmic properties AMERICAN CYANAMID COMPANY (US) 1999-03-02 US disclosed