SCHEMBL7992107

SCHEMBL7992107

c1ccc(CNCc2nccs2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.50
MAOB P27338 1/20 0.50
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PDPK1 O15530 1/20 0.44
BCHE P06276 1/20 0.43
SLC6A3 Q01959 1/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
MAOA P21397 1/20 0.41
TP53 P04637 1/20 0.41
THRB P10828 1/20 0.41
ROCK1 Q13464 1/20 0.41
CYP2C19 P33261 1/20 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
SCHEMBL2311217 0.84 CYP2C19 (0.46) KDM1AMAOBSLC6A3CYP2C19
SCHEMBL7447763 0.82 SIGMAR1 (0.53) KDM1AMAOBBCHE
SCHEMBL378027 0.77 PDPK1 (0.50) KDM1AMAOBKDM4EPDPK1SLC6A3
SCHEMBL2718512 0.76 MAOB (0.55) KDM1AMAOBMEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL3930720 0.76 PDPK1 (0.48) KDM1AMAOBKDM4EPDPK1SLC6A3
SCHEMBL6657646 0.76 PDPK1 (0.48) KDM1AMAOBKDM4EPDPK1SLC6A3
SCHEMBL7617248 0.76 PDPK1 (0.48) KDM1AMAOBKDM4EPDPK1SLC6A3
Hydrochloric Acid SCHEMBL31038658 0.73 MEN1 (0.70) KDM4EMEN1KMT2ATDP1BCHE
SCHEMBL1039947 0.73
Benzene SCHEMBL11697595 0.73 MEN1 (0.78) KDM4EMEN1KMT2ATDP1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3416948-B1 INDACENE BEARING SULFONYLUREAS AS ANTI-INFLAMMATORY AGENTS UNIV QUEENSLAND (AU) 2024-07-24 EP claimed
EP-0571471-A1 5-HETEROYL INDOLE DERIVATIVES. PFIZER (US) 1993-12-01 EP claimed
US-6277871-B1 ANTICANCER AGENTS ABBOTT LABORATORIES 2001-08-21 US disclosed