SCHEMBL7708655

SCHEMBL7708655

COc1cc(C2=CC=C(OCCc3ccc(Cl)cc3)NN2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CXCL12 P48061 3/20 0.42
MAOA P21397 1/20 0.40
DHCR7 Q9UBM7 1/20 0.39
TAAR1 Q96RJ0 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
KCNH2 Q12809 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
LMNA P02545 1/20 0.38
GLA P06280 1/20 0.38
PTPN1 P18031 1/20 0.37

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
SCHEMBL692557 0.72 CXCL12 (0.51) CXCL12MAOATAAR1TSHRMAPK1
SCHEMBL7816115 0.69 CXCL12 (0.65) CXCL12MAOA
SCHEMBL27758491 0.66 CALM1 (0.66) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL14515681 0.65 TAAR1 (0.75) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL29740697 0.63 PTPN1 (0.79) TAAR1TSHRMAPK1LMNAGLA
SCHEMBL31527873 0.63 TUBB4A (0.66) DHCR7TSHRLMNA
SCHEMBL27183174 0.63 TUBB4A (0.66) DHCR7TSHRLMNA
SCHEMBL363972 0.63 MAOB (0.61) CXCL12TAAR1TSHRMAPK1
SCHEMBL3693339 0.63 MAOB (0.67) CXCL12TAAR1TSHRMAPK1LMNA
SCHEMBL7717965 0.63 PTPN1 (0.62) TAAR1TSHRMAPK1KCNH2LMNA

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
WO-2011133600-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING PYRIDAZINE SULFONAMIDE DERIVATIVES INSTITUTE FOR ONEWORLD HEALTH (US) 2011-10-27 WO disclosed
WO-2010123822-A1 COMPOUNDS, COMPOSITIONS AND METHODS COMPRISING PYRIDAZINE SULFONAMIDE DERIVATIVES INSTITUTE FOR ONEWORLD HEALTH (US) 2010-10-28 WO disclosed