SCHEMBL9847533

SCHEMBL9847533

CCCOC1(C)CC(C)(C)c2ccc(Oc3ccc(N)cc3)cc2O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
MAPK1 P28482 2/20 0.40
MAPT P10636 4/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MEN1 O00255 1/20 0.34
MITF O75030 1/20 0.34
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34
KMT2A Q03164 1/20 0.34
NLRP1 Q9C000 1/20 0.34
NOD2 Q9HC29 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CYP3A4 P08684 2/20 0.33
TSHR P16473 1/20 0.33
TEAD4 Q15561 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32

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
SCHEMBL9847543 0.91 ALDH1A1 (0.42) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9749135 0.84 ALDH1A1 (0.44) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9847603 0.84 RXRA (0.31) RXRARXRBRXRGPPARGPPARA
SCHEMBL9847544 0.81 ALDH1A1 (0.42) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9847569 0.80 MTNR1B (0.37) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9847560 0.78 MEN1 (0.38) ALDH1A1SMN1; SMN2MEN1GAAKMT2A
SCHEMBL9749130 0.78 ALDH1A1 (0.46) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9847530 0.74 CYP3A4 (0.33) CYP3A4RXRARXRBRXRG
SCHEMBL9847605 0.71 ALDH1A1 (0.42) ALDH1A1MAPK1PPARGPPARA
SCHEMBL9847637 0.71 MTNR1B (0.38) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434074-A2 Process for the production of 1-lower alkoxy-1-lower alkyl-3-substituted phenylurea, and intermediate thereof and process for the production of the intermediate MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-06-26 EP disclosed