SCHEMBL9738176

SCHEMBL9738176

N#Cc1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ALDH1A1 P00352 2/20 0.55
TAS1R3 Q7RTX0 1/20 0.54
TAS1R1 Q7RTX1 1/20 0.54
TAS1R2 Q8TE23 1/20 0.54
LMNA P02545 3/20 0.51
HTT P42858 2/20 0.51
TSHR P16473 1/20 0.51
NLRP3 Q96P20 1/20 0.51
PKM P14618 2/20 0.50
RAB9A P51151 2/20 0.50
SAE1 Q9UBE0 1/20 0.50
UBA2 Q9UBT2 1/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.50
IL18 Q14116 1/20 0.50
EPHX2 P34913 1/20 0.49

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
SCHEMBL11238812 0.87 SMPD1 (0.50) MAPTMEN1KMT2AALDH1A1TAS1R3
SCHEMBL8669187 0.86 KMT2A (0.47) MAPTMEN1KMT2ATAS1R3TAS1R1
SCHEMBL7604101 0.83 RAB9A (0.57) MAPTMEN1KMT2ALMNAHTT
SCHEMBL7604198 0.83 TAS1R3 (0.78) MAPTMEN1KMT2AALDH1A1TAS1R3
SCHEMBL10608014 0.82 MAOA (0.51) MAPTMEN1KMT2ALMNAHTT
SCHEMBL7605886 0.81 KMT2A (0.59) MAPTMEN1KMT2AALDH1A1LMNA
Diflubenzuron SCHEMBL42416 0.81 RAB9A (0.59) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL11244486 0.81 RAB9A (0.55) MAPTMEN1KMT2ALMNAHTT
SCHEMBL10703352 0.81 KMT2A (0.53) MAPTMEN1KMT2ALMNAHTT
Diflubenzuron SCHEMBL18837607 0.81 RAB9A (0.59) MAPTMEN1KMT2AALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0193249-A2 Benzoyl urea derivatives having ati-tumor activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1986-09-03 EP claimed
EP-0107214-A2 Pharmaceutical compositions containing benzoyl-phenyl ureas with anti-tumour activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1984-05-02 EP claimed
US-5142064-A Larvicides has benzoyl or thiobenzoyl group DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1992-08-25 US disclosed
EP-0107214-A2 Pharmaceutical compositions containing benzoyl-phenyl ureas with anti-tumour activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1984-05-02 EP disclosed