SCHEMBL9733799

SCHEMBL9733799

CCOC(=O)c1ccc2c(c1)C(n1ccccc1=O)=CC(C)(C)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 2/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
PABPC1 P11940 2/20 0.37
APOBEC3A P31941 2/20 0.37
EIF4H Q15056 2/20 0.37
APOBEC3G Q9HC16 2/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
AKR1B1 P15121 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL10433122 0.84 F10 (0.40) ALDH1A1SMN1; SMN2KDM4EHSD17B10
SCHEMBL10433092 0.81 F10 (0.36)
SCHEMBL9733195 0.81 HRH4 (0.34)
SCHEMBL7277024 0.80 ALDH1A1 (0.42) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL9733913 0.77 TDP1 (0.37) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL9733018 0.77 HRH4 (0.34) ALDH1A1
SCHEMBL9733434 0.77 SLC6A2 (0.39) MEN1KMT2AAKR1B1
SCHEMBL9733534 0.76 TP53 (0.35) ALDH1A1MAPK1
SCHEMBL9734559 0.76 RXFP1 (0.39) MAPTALDH1A1MAPK1MEN1KMT2A
SCHEMBL9734404 0.76 MAOA (0.43) MAPTALDH1A1MEN1KMT2ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5132307-A TETRALIN COMPOUNDS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-07-21 US disclosed
EP-0368160-A1 Tetralin derivatives MERCK PATENT GmbH (DE) 1990-05-16 EP disclosed