SCHEMBL7467723

SCHEMBL7467723

CSCCC(=O)Nc1cc(-c2nc3cc(C(=O)Nc4ccc5nonc5c4N(CCCl)CCCl)ccc3[nH]2)n(C)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.34
HRAS P01112 4/20 0.33
ESR1 P03372 4/20 0.33
ESR2 Q92731 4/20 0.33
MAPT P10636 2/20 0.31
MAPK1 P28482 1/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7472043 0.85 HRAS (0.39) EGFRHRASESR1ESR2MAPT
SCHEMBL7471663 0.84 HRAS (0.46) EGFRHRASESR1ESR2MAPT
SCHEMBL7470676 0.84 HRAS (0.39) EGFRHRASESR1ESR2MAPT
SCHEMBL7466380 0.83 MEN1 (0.41) EGFRMAPTMAPK1MEN1POLB
SCHEMBL7470847 0.82 HRAS (0.39) EGFRHRASESR1ESR2MAPT
SCHEMBL7476267 0.82 HRAS (0.39) EGFRHRASESR1ESR2MAPT
SCHEMBL7459798 0.81 HRAS (0.38) EGFRHRASESR1ESR2MAPT
SCHEMBL7472474 0.79 HRAS (0.42) EGFRHRASESR1ESR2MEN1
SCHEMBL7472023 0.75 HRAS (0.51) EGFRHRASESR1ESR2MAPT
Hydrochloric Acid SCHEMBL7473594 0.74 HRAS (0.40) EGFRHRASESR1ESR2MAPT

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
EP-0711768-B1 BENZIMIDAZOLE DERIVATIVE MITSUI CHEMICALS INC (JP) 2002-02-13 EP disclosed
EP-0711768-A1 BENZIMIDAZOLE DERIVATIVE MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-05-15 EP disclosed