SCHEMBL7968690

SCHEMBL7968690

CC(=O)c1c(O)cc(=O)oc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
HPGD P15428 3/20 0.48
CYP3A4 P08684 3/20 0.48
GAA P10253 1/20 0.46
KDM4E B2RXH2 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTT P42858 2/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
CA9 Q16790 1/20 0.43
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
ALDH1A1 P00352 4/20 0.41
LMNA P02545 2/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.41
MITF O75030 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL9788316 0.79 ALDH1A1 (0.56) MEN1KMT2AHPGDCYP3A4GAA
SCHEMBL2574998 0.74 CYP3A4 (0.46) MEN1KMT2AHPGDCYP3A4GAA
SCHEMBL1308058 0.72 KMT2A (0.59) MEN1KMT2AHPGDCYP3A4GAA
SCHEMBL11227804 0.71 KMT2A (0.58) MEN1KMT2AHPGDCYP3A4GAA
SCHEMBL11843818 0.70 POLB (0.57) MEN1KMT2AHPGDCYP3A4GAA
SCHEMBL1975589 0.69 KDM4E (0.61) MEN1KMT2AHPGDGAAKDM4E
SCHEMBL1682172 0.69 CYP3A4 (0.68) MEN1KMT2AHPGDCYP3A4GAA
SCHEMBL5188741 0.68 KDM4E (0.59) MEN1KMT2AHPGDGAAKDM4E
SCHEMBL7963459 0.68 ALDH1A1 (0.45) MEN1KMT2AHPGDCYP3A4GAA
SCHEMBL11861102 0.68 KDM4E (0.59) MEN1KMT2AHPGDGAAKDM4E

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-6215016-B1 HEMATOPOIETIC AGENTS; PREVENTING CYTOPENIA TORAY INDUSTRIES, INC. (JP) 2001-04-10 US disclosed
EP-0841063-A1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1998-05-13 EP disclosed