SCHEMBL8867975

SCHEMBL8867975

COC(=O)CNC(=O)c1ccc(C(=O)NS(=O)(=O)c2cccc(CCNC(=O)C3CCCCC3)c2)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
TSHR P16473 3/20 0.43
LMNA P02545 3/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2C19 P33261 3/20 0.43
CYP2C9 P11712 2/20 0.43
BLM P54132 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HTR1A P08908 1/20 0.43
NFKB1 P19838 1/20 0.43
CNR1 P21554 1/20 0.43
ADRA1A P35348 1/20 0.43
P4HTM Q9NXG6 2/20 0.40
ALDH1A1 P00352 7/20 0.39
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL8869208 0.91 MAPT (0.45) MAPTTSHRLMNACYP3A4CYP2C19
SCHEMBL9138843 0.90 MAPT (0.43) MAPTTSHRLMNACYP3A4CYP2C19
SCHEMBL8867649 0.90 MAPT (0.53) MAPTTSHRLMNACYP3A4CYP2C19
SCHEMBL8869420 0.90 SMN1; SMN2 (0.46) MAPTTSHRLMNACYP3A4CYP2C19
SCHEMBL8869358 0.89 EPHX2 (0.43) MAPTTSHRLMNACYP3A4CYP2C19
SCHEMBL9138316 0.88 P4HTM (0.54) MAPTTSHRLMNACYP3A4CYP2C19
SCHEMBL8869629 0.87 P4HTM (0.45) MAPTLMNASMN1; SMN2P4HTMALDH1A1
SCHEMBL8869834 0.85 P4HTM (0.48) MAPTLMNASMN1; SMN2P4HTMALDH1A1
SCHEMBL8869191 0.85 PPARA (0.48) MAPTLMNASMN1; SMN2P4HTMALDH1A1
SCHEMBL9018275 0.84 ACKR3 (0.41) MAPTTSHRLMNACYP3A4CYP2C19

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-5607954-A Sulfonamido- and sulfonamidocarbonylpyridine-2-carboxamides and their pyridine-n-oxides, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed