SCHEMBL9028765

SCHEMBL9028765

CC[C@H](C)c1ccc(C=O)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
ALDH1A1 P00352 5/20 0.36
GAA P10253 1/20 0.36
LMNA P02545 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
THRB P10828 1/20 0.35
BLM P54132 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
IMPDH2 P12268 2/20 0.35
MCL1 Q07820 2/20 0.35
KDM4E B2RXH2 2/20 0.34
PABPC1 P11940 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP2A6 P11509 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33

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
SCHEMBL28682429 0.82 MEN1 (0.41) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL27958818 0.79 MEN1 (0.38) TSHRALDH1A1GAALMNAMEN1
SCHEMBL5837362 0.78 TSHR (0.53) TSHRALDH1A1GAALMNAMEN1
SCHEMBL2649379 0.76 KMT2A (0.36) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL2646640 0.76 IMPDH2 (0.34) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL2650310 0.75 TSHR (0.45) TSHRALDH1A1GAALMNAMEN1
SCHEMBL7823512 0.74 CYP1A2 (0.52) TSHRALDH1A1MCL1KDM4EPABPC1
SCHEMBL29786760 0.74 KMT2A (0.61) TSHRALDH1A1GAALMNAMEN1
SCHEMBL982388 0.74 KMT2A (0.61) TSHRALDH1A1GAALMNAMEN1
SCHEMBL7823511 0.73 TSHR (0.47) TSHRKDM4EHSP90AA1L3MBTL1TLR8

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-0703905-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO. INC. (US) 1996-04-03 EP disclosed