SCHEMBL11102123

SCHEMBL11102123

Cc1ncnc(NCCOc2ccccc2Cl)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ PKM P14618 1/20 0.47
▸ RAB9A P51151 5/20 0.45
▸ NPC1 O15118 4/20 0.45
▸ DRD2 P14416 1/20 0.45
▸ DRD4 P21917 1/20 0.45
▸ DRD3 P35462 1/20 0.45
▸ CYP1A2 P05177 2/20 0.44
▸ CYP3A4 P08684 2/20 0.44
▸ AURKA O14965 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ EGFR P00533 2/20 0.43
▸ ERBB2 P04626 2/20 0.43
▸ BRD4 O60885 1/20 0.43
▸ ERBB4 Q15303 1/20 0.43
▸ SLC2A1 P11166 1/20 0.42
▸ L3MBTL1 Q9Y468 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ HPGD P15428 2/20 0.41

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
SCHEMBL11101829 0.89 KMT2A (0.47) MEN1KMT2APKMRAB9ANPC1
SCHEMBL11109252 0.86 DRD2 (0.47) MEN1KMT2ARAB9ANPC1DRD2
SCHEMBL11108141 0.83 L3MBTL1 (0.47) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL11106513 0.82 LMNA (0.45) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL11103526 0.82 ALDH1A1 (0.49) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL11100661 0.81 PPARD (0.41) CYP1A2CYP3A4CYP2D6EGFRERBB2
SCHEMBL11102255 0.80 PIK3CD (0.53) RAB9ANPC1DRD2DRD4DRD3
SCHEMBL11105878 0.80 HTR1B (0.41) MEN1KMT2APKMRAB9ANPC1
SCHEMBL11102766 0.79 KDM4E (0.45) MEN1KMT2ARAB9ANPC1CYP1A2
SCHEMBL11102923 0.79 KDM4E (0.44) CYP1A2CYP3A4CYP2D6EGFRERBB2

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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