SCHEMBL8946480

SCHEMBL8946480

CC(=O)N1c2ccc(C)cc2C2(C)Cc3ccccc3C12C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
HSD17B3 P37058 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
NPSR1 Q6W5P4 2/20 0.40
ADRB2 P07550 1/20 0.40
TP53 P04637 3/20 0.39
NOTUM Q6P988 3/20 0.39
FSHR P23945 3/20 0.39
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.38
TSHR P16473 2/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CRHBP P24387 1/20 0.36
CYP2C19 P33261 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
SCHEMBL8946472 1.00 MAPT (0.42) MAPTHSD17B3MEN1KMT2ANPSR1
SCHEMBL8946465 1.00 MAPT (0.42) MAPTHSD17B3MEN1KMT2ANPSR1
SCHEMBL8946379 0.86 MEN1 (0.49) MAPTHSD17B3MEN1KMT2ANPSR1
SCHEMBL8946367 0.86 MEN1 (0.49) MAPTHSD17B3MEN1KMT2ANPSR1
SCHEMBL8946372 0.86 MEN1 (0.49) MAPTHSD17B3MEN1KMT2ANPSR1
SCHEMBL9018952 0.84 MEN1 (0.38) MAPTHSD17B3MEN1KMT2ANPSR1
SCHEMBL8946924 0.84 MEN1 (0.38) MAPTHSD17B3MEN1KMT2ANPSR1
SCHEMBL9018953 0.84 MEN1 (0.38) MAPTHSD17B3MEN1KMT2ANPSR1
SCHEMBL8946412 0.81 BACE1 (0.36) MAPTMEN1KMT2ATP53KDM4E
SCHEMBL8946423 0.81 BACE1 (0.36) MAPTMEN1KMT2ATP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516788-A TREATMENT OF ATHEROSCLEROSIS; ANTIISCHEMIC, ANTICARCINOGENIC AGENTS; ANTICOAGULANTS UNIVERSITY OF BATH (GB) 1996-05-14 US disclosed
EP-0409410-B1 Indenoindole compounds UNIV BATH (GB) 1996-03-20 EP disclosed
WO-1990015799-A1 INDENOINDOLE COMPOUNDS II UNIVERSITY OF BATH (GB) 1990-12-27 WO disclosed