SCHEMBL9847544

SCHEMBL9847544

CC(C)OC1(C)CC(C)(C)c2ccc(Oc3ccc(N)cc3)cc2O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
MAPK1 P28482 2/20 0.42
MAPT P10636 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MITF O75030 1/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36
NLRP1 Q9C000 1/20 0.36
NOD2 Q9HC29 1/20 0.36
TDP1 Q9NUW8 2/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
TEAD4 Q15561 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
POLB P06746 1/20 0.33
NPC1 O15118 2/20 0.31

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
SCHEMBL9749135 0.86 ALDH1A1 (0.44) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9847543 0.83 ALDH1A1 (0.42) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9847533 0.81 ALDH1A1 (0.40) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9847593 0.81 ALDH1A1 (0.42) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9749130 0.80 ALDH1A1 (0.46) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL9847572 0.80 MEN1 (0.38) MAPK1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL9847651 0.77 MEN1 (0.40) MEN1KMT2ATDP1POLBRAB9A
SCHEMBL16248010 0.71 SMN1; SMN2 (0.49) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL203793 0.70 SMN1; SMN2 (0.47) ALDH1A1MAPK1MAPTSMN1; SMN2MEN1
SCHEMBL29608602 0.70 SMN1; SMN2 (0.47) 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