SCHEMBL11049020

SCHEMBL11049020

CC(C)Oc1ccc(NC(=O)C2(C)CC2)cc1Cl

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 6/20 0.67
P2RX3 P56373 2/20 0.45
MAPT P10636 8/20 0.44
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
HTT P42858 5/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
NPSR1 Q6W5P4 2/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
POLB P06746 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 4/20 0.44
GAA P10253 2/20 0.44
XBP1 P17861 1/20 0.44
CCR6 P51684 1/20 0.44

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
SCHEMBL11054922 0.88 MAPT (0.57) RORCMAPTMEN1KMT2AHTT
SCHEMBL11435252 0.85 RORC (0.47) RORCP2RX3MAPTSMN1; SMN2RAB9A
SCHEMBL11566094 0.85 SMN1; SMN2 (0.57) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL11563192 0.85 RORC (0.64) RORCP2RX3MAPTMEN1KMT2A
SCHEMBL11564649 0.84 RORC (0.46) RORCP2RX3MAPTMEN1KMT2A
SCHEMBL11565621 0.84 KCNQ3 (0.47) RORCP2RX3SMN1; SMN2RAB9ANPC1
SCHEMBL11442327 0.83 RORC (0.45) RORCP2RX3MAPTMEN1KMT2A
SCHEMBL11562798 0.82 RORC (0.67) RORCP2RX3MAPTMEN1KMT2A
SCHEMBL11564073 0.81 RXRA (0.48) RORCP2RX3MAPTMEN1KMT2A
SCHEMBL11050975 0.81 PNLIP (0.49) RORCMAPTMEN1KMT2ASMN1; SMN2

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-0052473-B1 N-SUBSTITUTED PHENYL-1-METHYLCYCLOPROPANECARBOXAMIDES, THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-08-22 EP disclosed
US-4447260-A N-Substituted phenyl-1-methylcyclopropanecarboxamides, and their herbicidal use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-05-08 US disclosed
EP-0052473-A2 N-Substituted phenyl-1-methylcyclopropanecarboxamides, their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-05-26 EP disclosed
US-4166735-A Cycloalkanecarboxanilide derivative herbicides SHELL OIL COMPANY (US) 1979-09-04 US disclosed