SCHEMBL10367948

SCHEMBL10367948

CCCCC(Nc1nc(C)c(OC)c(C)n1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CACNA2D1 P54289 1/20 0.41
▸ TACR3 P29371 5/20 0.38
▸ MAPT P10636 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ POLB P06746 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ TACR2 P21452 1/20 0.36
▸ TLR7 Q9NYK1 1/20 0.36
▸ SLC2A1 P11166 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ GPR88 Q9GZN0 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ CRHR1 P34998 3/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ IDO1 P14902 1/20 0.34

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
SCHEMBL10368160 0.96 CACNA2D1 (0.41) CACNA2D1TACR3MAPTMEN1KMT2A
Phosphoric Acid SCHEMBL10367954 0.93 TACR3 (0.41) CACNA2D1TACR3POLBALDH1A1TACR2
SCHEMBL9530133 0.83 CACNA2D1 (0.43) CACNA2D1TACR3MAPTSMN1; SMN2POLB
SCHEMBL9527790 0.82 TACR3 (0.41) CACNA2D1TACR3KMT2AMAPK1POLB
SCHEMBL9529074 0.81 NCEH1 (0.43) CACNA2D1TACR3POLBALDH1A1GPR88
SCHEMBL9527699 0.81 TACR3 (0.40) CACNA2D1TACR3POLBGPR88
SCHEMBL10368162 0.81 METAP1 (0.37) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL9528534 0.80 TACR3 (0.42) CACNA2D1TACR3SMN1; SMN2POLBGPR88
SCHEMBL9529634 0.80 TACR3 (0.42) CACNA2D1TACR3MAPTSMN1; SMN2POLB
SCHEMBL9528223 0.79 TACR3 (0.41) CACNA2D1TACR3SMN1; SMN2POLBGPR88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0210044-B1 HYDROXY AND ALKOXY PYRIMIDINES PFIZER INC. (US) 1990-08-29 — — EP claimed
US-4711888-A Hydroxy and alkoxy pyrimidines PFIZER INC. (US) 1987-12-08 — — US claimed
EP-0210044-A2 Hydroxy and alkoxy pyrimidines PFIZER INC. (US) 1987-01-28 — — EP claimed
EP-0210044-B1 HYDROXY AND ALKOXY PYRIMIDINES PFIZER INC. (US) 1990-08-29 — — EP disclosed
US-4711888-A Hydroxy and alkoxy pyrimidines PFIZER INC. (US) 1987-12-08 — — US disclosed
EP-0210044-A2 Hydroxy and alkoxy pyrimidines PFIZER INC. (US) 1987-01-28 — — EP disclosed
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