SCHEMBL9739272

SCHEMBL9739272

Cc1cc(Cl)nc(Nc2cccc(Cl)c2)n1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.66
MAPT P10636 3/20 0.54
KDM4E B2RXH2 2/20 0.54
MAPK1 P28482 2/20 0.54
LMNA P02545 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ABCB1 P08183 1/20 0.52
ABCC1 P33527 1/20 0.52
ABCG2 Q9UNQ0 1/20 0.52
NFKB1 P19838 1/20 0.51
MEN1 O00255 3/20 0.50
GAA P10253 1/20 0.50
ALDH1A1 P00352 1/20 0.49
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
HSP90AA1 P07900 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL3957572 0.92 MAPT (0.58) KMT2AMAPTKDM4EMAPK1LMNA
SCHEMBL3708228 0.85 TAAR1 (0.61) KMT2AMAPTKDM4EMAPK1LMNA
SCHEMBL14368046 0.82 NPC1 (0.54) KMT2AMAPTKDM4EMAPK1LMNA
SCHEMBL3718787 0.81 NPC1 (0.53) KMT2AMAPTKDM4EMAPK1LMNA
SCHEMBL4544826 0.80 NFKB1 (0.73) KMT2AMAPTKDM4EMAPK1LMNA
SCHEMBL4544792 0.80 NFKB1 (0.73) KMT2AMAPTKDM4EMAPK1LMNA
SCHEMBL18037971 0.80 KMT2A (1.00) KMT2AMAPTLMNASMN1; SMN2NFKB1
SCHEMBL4544831 0.79 APP (0.62) KMT2AMAPTKDM4EMAPK1NFKB1
SCHEMBL11291398 0.78 SYK (0.59) KMT2AMAPTKDM4EMAPK1ABCB1
SCHEMBL8526184 0.78 NFKB1 (0.69) KMT2AMAPTKDM4EMAPK1LMNA

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-0337943-A2 N-Phenyl-N-pyrimidin-2-yl-ureas with herbicidal and plant-growth regulating activity CIBA-GEIGY AG (CH) 1989-10-18 EP claimed
US-5159078-A Herbicides, plant growth regulator CIBA-GEIGY CORPORATION (US) 1992-10-27 US disclosed
US-4966622-A HERBICIDES, PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1990-10-30 US disclosed
EP-0337943-A2 N-Phenyl-N-pyrimidin-2-yl-ureas with herbicidal and plant-growth regulating activity CIBA-GEIGY AG (CH) 1989-10-18 EP disclosed