SCHEMBL9724093

SCHEMBL9724093

ONCc1ccc(Sc2ccc(Cl)cc2)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
PTGIR P43119 2/20 0.33
NPSR1 Q6W5P4 3/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
BLM P54132 1/20 0.33
NOD2 Q9HC29 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
POLB P06746 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
MAPT P10636 3/20 0.32
RAB9A P51151 2/20 0.32
NPC1 O15118 1/20 0.32
HTT P42858 1/20 0.32
HDAC1 Q13547 2/20 0.31
HDAC8 Q9BY41 2/20 0.31
HDAC6 Q9UBN7 2/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL9724109 0.83 THRB (0.39) MEN1KMT2AALDH1A1BLMPOLB
SCHEMBL19259920 0.82 POLB (0.37) MEN1KMT2ANPSR1ALDH1A1LMNA
SCHEMBL9724100 0.82 KDM4E (0.48) MEN1KMT2AALDH1A1LMNAPOLB
SCHEMBL9538802 0.81 RHEB (0.39) MEN1KMT2APTGIRNPSR1ALDH1A1
SCHEMBL9724095 0.80 TP53 (0.40) MEN1KMT2APTGIRALDH1A1POLB
SCHEMBL13067234 0.78 DHFR (0.36) MEN1KMT2APTGIRNPSR1MAOA
SCHEMBL9724126 0.75 KDM4E (0.47) NPSR1ALDH1A1LMNAPOLBMAPT
SCHEMBL19274531 0.75 GAA (0.44) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL13026621 0.74 HPGD (0.37) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL28649609 0.73 ICAM1 (0.39) MEN1KMT2APTGIRNPSR1ALDH1A1

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
US-5158971-A Antiallergens, antiinflammatory agents LILLY INDUSTRIES LIMITED (GB) 1992-10-27 US disclosed
EP-0459748-A2 Thien-2-yl methylurea derivatives as leukotriene inhibitors LILLY INDUSTRIES LIMITED (GB) 1991-12-04 EP disclosed