SCHEMBL10375307

SCHEMBL10375307

CCOC(=O)c1c(C)nc(-c2cccnc2)nc1-c1cc([N+](=O)[O-])ccc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPK1 P28482 1/20 0.43
DCTPP1 Q9H773 1/20 0.42
KDM4E B2RXH2 2/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ACHE P22303 3/20 0.42
CYP19A1 P11511 3/20 0.42
CYP11B1 P15538 3/20 0.42
CYP11B2 P19099 3/20 0.42
CACNB4 O00305 1/20 0.42
CACNA1A O00555 1/20 0.42
CACNA1G O43497 1/20 0.42
CACNG3 O60359 1/20 0.42
CACNA1F O60840 1/20 0.42
CACNA1H O95180 1/20 0.42
BCHE P06276 1/20 0.42
CACNB3 P54284 1/20 0.42

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
SCHEMBL10375437 0.91 MAPT (0.42) MAPTALDH1A1MAPK1DCTPP1KDM4E
SCHEMBL10375516 0.90 KDM4E (0.54) MAPTALDH1A1MAPK1KDM4ETP53
SCHEMBL10375306 0.90 CACNA1C (0.42) MAPTALDH1A1MAPK1DCTPP1KDM4E
SCHEMBL10376545 0.88 MAPT (0.49) MAPTALDH1A1MAPK1DCTPP1KDM4E
SCHEMBL10375315 0.80 KDM4E (0.52) MAPTALDH1A1MAPK1KDM4ETP53
SCHEMBL10375265 0.80 KMT2A (0.46) MAPTALDH1A1KDM4ERAB9AABCG2
SCHEMBL10375515 0.79 KDM4E (0.50) MAPTALDH1A1MAPK1KDM4ETP53
SCHEMBL10375512 0.78 KDM4E (0.49) MAPTALDH1A1MAPK1KDM4ETP53
SCHEMBL10375290 0.78 KDM4E (0.49) MAPTALDH1A1MAPK1KDM4ETP53
SCHEMBL10375294 0.77 KMT2A (0.48) MAPTALDH1A1KDM4ERAB9AABCG2

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-0169712-B1 NEW PYRIMIDINE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND COMPOSITION CONTAINING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-12-12 EP disclosed
US-4698340-A TREATMENT OF CEREBROVASCULAR DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-10-06 US disclosed
EP-0169712-A2 New pyrimidine derivatives, processes for preparation thereof and composition containing the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-29 EP disclosed