SCHEMBL11045452

SCHEMBL11045452

Cc1cc2c(C)nc(NC(=O)NS(=O)(=O)c3c(Cl)ccc4ccccc34)nc2o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
HTT P42858 1/20 0.37
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
EGFR P00533 1/20 0.35
KDR P35968 1/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
GAA P10253 1/20 0.34
S1PR4 O95977 1/20 0.34
NLRP3 Q96P20 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL10956496 0.84 NPC1 (0.52) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL11045687 0.82 GAA (0.44) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL11042105 0.81 ALDH1A1 (0.41) MAPTNPC1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL11045131 0.81 NPC1 (0.43) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL10955488 0.79 MAPT (0.43) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL11045417 0.79 ALDH1A1 (0.45) MAPTNPC1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL10850605 0.78 MAPT (0.42) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL11041517 0.78 GAA (0.55) MAPTNPC1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL10957026 0.78 ALDH1A1 (0.41) MAPTNPC1RAB9AALDH1A1KDM4E
SCHEMBL11047117 0.77 ALDH1A1 (0.35) MAPTNPC1RAB9AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4370479-A PLANT GROWTH REGULATOR E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-25 US claimed
EP-0030141-A2 Herbicidal ureas and isoureas, preparation, compositions and use thereof, intermediates therefor and preparation of said intermediates E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-06-10 EP claimed
US-4460404-A HERBICIDES PLANT GROWTH REGULATORS E. I. DUPONT DE NEMOURS AND COMPANY (US) 1984-07-17 US disclosed
EP-0030141-B1 HERBICIDAL UREAS AND ISOUREAS, PREPARATION, COMPOSITIONS AND USE THEREOF, INTERMEDIATES THEREFOR AND PREPARATION OF SAID INTERMEDIATES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-06-20 EP disclosed
US-4452627-A HERBICIDE, PLANT GROWTH REGULATOR E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-06-05 US disclosed
US-4370479-A PLANT GROWTH REGULATOR E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-25 US disclosed
EP-0030141-A2 Herbicidal ureas and isoureas, preparation, compositions and use thereof, intermediates therefor and preparation of said intermediates E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-06-10 EP disclosed