SCHEMBL11879235

SCHEMBL11879235

CNC(=O)N[C@H]1[C@H](O)[C@@H](OC)O[C@@H]2COC(c3ccccc3)O[C@@H]12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.67
▸ MEN1 O00255 2/20 0.67
▸ L3MBTL1 Q9Y468 3/20 0.64
▸ ALDH1A1 P00352 4/20 0.41
▸ PKM P14618 1/20 0.41
▸ MAPT P10636 3/20 0.32
▸ LMNA P02545 2/20 0.32
▸ ATM Q13315 2/20 0.32
▸ MITF O75030 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ LGALS8 O00214 1/20 0.31
▸ SELP P16109 1/20 0.31
▸ BCHE P06276 1/20 0.31
▸ PDCD1 Q15116 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HCRTR1 O43613 1/20 0.31

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
SCHEMBL11881272 1.00 KMT2A (0.67) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL7155441 0.89 KMT2A (0.69) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL18241590 0.88 KMT2A (0.67) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL11068533 0.83 KMT2A (0.61) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL7928137 0.82 KMT2A (0.92) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL24236918 0.81 KMT2A (0.69) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL12930889 0.81 KMT2A (0.69) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL7150336 0.81 KMT2A (0.69) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL7150056 0.81 KMT2A (0.69) KMT2AMEN1L3MBTL1ALDH1A1PKM
SCHEMBL16308901 0.81 KMT2A (0.69) KMT2AMEN1L3MBTL1ALDH1A1PKM

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
US-3940383-A ANTICANCER STANFORD RESEARCH INSTITUTE (US) 1976-02-24 — — US disclosed
Send feedback