SCHEMBL11109253

SCHEMBL11109253

CC(C)c1ccccc1OCCCNc1ncnc(Cl)c1C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.45
▸ LMNA P02545 6/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.42
▸ KDM4E B2RXH2 5/20 0.39
▸ MAPK1 P28482 4/20 0.39
▸ HTT P42858 4/20 0.39
▸ TSHR P16473 3/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ POLB P06746 1/20 0.38

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
SCHEMBL11101312 0.88 DRD2 (0.43) ALDH1A1LMNAMEN1CYP1A2CYP3A4
SCHEMBL11110238 0.88 LMNA (0.45) ALDH1A1LMNAL3MBTL1MEN1CYP1A2
SCHEMBL11110872 0.85 LMNA (0.50) ALDH1A1LMNAL3MBTL1MEN1CYP1A2
SCHEMBL11101473 0.84 LMNA (0.43) ALDH1A1LMNAL3MBTL1MEN1CYP1A2
SCHEMBL11104530 0.84 LMNA (0.52) ALDH1A1LMNAL3MBTL1MEN1CYP1A2
SCHEMBL11100849 0.83 ALDH1A1 (0.43) ALDH1A1LMNAL3MBTL1MEN1CYP1A2
SCHEMBL11111799 0.81 PDE5A (0.39) ALDH1A1LMNACYP1A2CYP3A4CYP2C19
SCHEMBL11106353 0.80 LMNA (0.50) ALDH1A1LMNAL3MBTL1MEN1CYP1A2
SCHEMBL11291172 0.80 LMNA (0.43) ALDH1A1LMNAL3MBTL1MEN1CYP1A2
SCHEMBL11106513 0.77 LMNA (0.45) ALDH1A1LMNAL3MBTL1MEN1CYP1A2

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-4435402-A Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY, LIMITED (JP) 1984-03-06 — — US disclosed
EP-0057440-A1 Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY LIMITED (JP) 1982-08-11 — — EP disclosed
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