SCHEMBL21548886

SCHEMBL21548886

CCOc1nc(C)nc(CC)c1Cc1cccc(Cl)c1F

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 1/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MPO P05164 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ GRM5 P41594 2/20 0.33
▸ P2RX7 Q99572 1/20 0.32
▸ GAA P10253 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CNR2 P34972 1/20 0.31
▸ CCR4 P51679 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ CRHR1 P34998 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
SCHEMBL21548857 0.86 KMT2A (0.34) L3MBTL1ALDH1A1KMT2AATMGRM5
SCHEMBL20356518 0.83 KMO (0.39) GRM4L3MBTL1ALDH1A1KMT2AATM
SCHEMBL21548814 0.83 LMNA (0.39) L3MBTL1ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL21548885 0.82 CD38 (0.39) GRM4L3MBTL1ALDH1A1KMT2AMPO
Hydrochloric Acid SCHEMBL21526103 0.82 KMO (0.38) GRM4L3MBTL1ALDH1A1KMT2AATM
SCHEMBL21548856 0.81 HTT (0.40) ALDH1A1KMT2AP2RX7MEN1SMN1; SMN2
SCHEMBL21526068 0.75 PTPN11 (0.36) L3MBTL1ALDH1A1KMT2AATMP2RX7
SCHEMBL21548940 0.75 CCR4 (0.35) L3MBTL1ALDH1A1KMT2AMEN1CCR4
SCHEMBL21526043 0.74 GAA (0.39) L3MBTL1ALDH1A1KMT2AATMGAA
SCHEMBL21526129 0.72 GAA (0.33) L3MBTL1ALDH1A1KMT2AATMGAA

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-3564216-B1 PYRIMIDINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2021-10-27 — — EP disclosed
EP-3564216-A1 PYRIMIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-11-06 — — EP disclosed
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