SCHEMBL10690124

SCHEMBL10690124

CCC1c2ccccc2OC(=O)Oc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
USP2 O75604 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GRM8 O00222 1/20 0.41
GRM7 Q14831 1/20 0.41
GRM4 Q14833 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
PKM P14618 1/20 0.40
MAPT P10636 1/20 0.40
ATM Q13315 1/20 0.39
HTT P42858 1/20 0.39
POLB P06746 1/20 0.37
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37

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
SCHEMBL29737271 0.88 MAOA (0.52) KMT2AMEN1USP2L3MBTL1TSHR
SCHEMBL1077580 0.88 MAOA (0.52) KMT2AMEN1USP2L3MBTL1TSHR
SCHEMBL9854638 0.85 KMT2A (0.44) KMT2AMEN1USP2L3MBTL1TSHR
SCHEMBL17875264 0.85 KMT2A (0.45) KMT2AMEN1USP2L3MBTL1TSHR
SCHEMBL10837410 0.85 KMT2A (0.45) KMT2AMEN1USP2L3MBTL1TSHR
SCHEMBL11058577 0.79 KMT2A (0.38) KMT2AMEN1USP2L3MBTL1TSHR
SCHEMBL13893713 0.79 KMT2A (0.44) KMT2AMEN1USP2L3MBTL1TSHR
SCHEMBL10692504 0.78 MAOA (0.45) KMT2AMEN1USP2L3MBTL1TSHR
SCHEMBL22992500 0.77 KMT2A (0.41) KMT2AMEN1USP2L3MBTL1TSHR
Bicarbonate SCHEMBL7904308 0.76 KMT2A (0.44) KMT2AMEN1USP2L3MBTL1TSHR

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
EP-0256554-A2 Plastic substrate for optical memory card or disk Teijin Chemicals, Ltd. (JP) 1988-02-24 EP claimed
EP-0256554-A2 Plastic substrate for optical memory card or disk Teijin Chemicals, Ltd. (JP) 1988-02-24 EP disclosed