SCHEMBL10368712

SCHEMBL10368712

CCCCC(CNc1ncc(O)c(-c2ccccc2)n1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 5/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ METAP1 P53582 3/20 0.35
▸ TACR3 P29371 2/20 0.34
▸ AXL P30530 2/20 0.34
▸ TYRO3 Q06418 2/20 0.34
▸ MERTK Q12866 2/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ KLK7 P49862 1/20 0.34
▸ GCGR P47871 2/20 0.33

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
SCHEMBL10367530 0.85 METAP1 (0.39) ALDH1A1GLAGAAKDM4EMETAP1
SCHEMBL10368710 0.79 TACR3 (0.43) CYP1A2CYP2C9TACR3
SCHEMBL10371119 0.78 ADORA1 (0.50) ADORA1ALDH1A1GLAGAAKDM4E
SCHEMBL10367538 0.78 ADORA1 (0.50) ADORA1ALDH1A1GLAGAAKDM4E
SCHEMBL10368263 0.77 METAP1 (0.39) ALDH1A1GLAGAAKDM4EMETAP1
SCHEMBL9529639 0.76 ALDH1A1 (0.39) ALDH1A1TP53GLAGAAKDM4E
SCHEMBL10533280 0.73 LMNA (0.47) ALDH1A1TP53CYP1A2GLAGAA
SCHEMBL10368162 0.71 METAP1 (0.37) ALDH1A1TP53GLAGAAKDM4E
Phosphoric Acid SCHEMBL9531941 0.71 POLB (0.36) ALDH1A1KDM4EMETAP1TACR3POLB
SCHEMBL10369840 0.70 POLB (0.36) ALDH1A1KDM4EMETAP1GCGRPOLB

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 3 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 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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