SCHEMBL10366279

SCHEMBL10366279

CC(=O)Oc1cc2c(cc1/C=C/c1cccs1)OCC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
SLC6A9 P48067 1/20 0.38
ALDH1A1 P00352 4/20 0.37
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
ERN1 O75460 1/20 0.35
CTNNB1 P35222 1/20 0.35
WNT3A P56704 1/20 0.35
ALOX5 P09917 2/20 0.35
PTGS1 P23219 2/20 0.35
PTGS2 P35354 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HCAR2 Q8TDS4 1/20 0.35
HPGD P15428 1/20 0.34
TNFRSF1A P19438 1/20 0.34
CYP1A1 P04798 2/20 0.34

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
SCHEMBL10366281 1.00 MAPT (0.41) MAPTSLC6A9ALDH1A1KMT2ASMN1; SMN2
SCHEMBL10366232 0.77 ERN1 (0.48) ALDH1A1SMN1; SMN2LMNAGAAERN1
SCHEMBL7211706 0.76 MEN1 (0.48) MAPTALDH1A1KMT2ALMNAHTT
SCHEMBL10366785 0.75 SLC6A9 (0.40) MAPTSLC6A9ALDH1A1KMT2ASMN1; SMN2
SCHEMBL10958722 0.70 PGR (0.44) ALDH1A1SMN1; SMN2LMNAGAAERN1
SCHEMBL7365668 0.69 MEN1 (0.42) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL9479673 0.65 MAPT (0.52) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL7791640 0.64 MEN1 (0.41) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL6266662 0.64 CA2 (0.61) MAPTALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL3261357 0.62 CA2 (0.50) MAPTALDH1A1SMN1; SMN2ERN1CTNNB1

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-0199235-B1 PHENYLALKYL-2,3-DIHYDROBENZOFURANS AND ANALOGS USEFUL AS ANTI-INFLAMMATORY AGENTS MERCK & CO. INC. (US) 1990-08-08 EP disclosed
US-4775679-A Certain heterocyclic-ethyl-2,3-dihydrobenzofurans useful as anti-inflammatory agents MERCK & CO., INC. (US) 1988-10-04 US disclosed
US-4713393-A TOPICAL TREATMENT OF SKIN DISORDERS MERCK & CO., INC. (US) 1987-12-15 US disclosed
EP-0199235-A2 Phenylalkyl-2,3-dihydrobenzofurans and analogs useful as anti-inflammatory agents MERCK & CO. INC. (US) 1986-10-29 EP disclosed