SCHEMBL10375348

SCHEMBL10375348

COC(=O)c1c(C)nc(-c2ccccc2)nc1-c1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.43
MEN1 O00255 5/20 0.43
ALDH1A1 P00352 1/20 0.43
AR P10275 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PAX8 Q06710 1/20 0.41
ABCG2 Q9UNQ0 4/20 0.41
ABCC1 P33527 2/20 0.41
ABCB1 P08183 1/20 0.41
F2 P00734 1/20 0.41
PLAU P00749 1/20 0.41
KLKB1 P03952 1/20 0.41
ELANE P08246 1/20 0.41
CTRB1 P17538 1/20 0.41
PLA2G2A P14555 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 2/20 0.39
RORC P51449 2/20 0.39

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
SCHEMBL10375315 0.90 KDM4E (0.52) ALDH1A1ARNPC1RAB9AELANE
SCHEMBL10375265 0.90 KMT2A (0.46) KMT2AMEN1ALDH1A1ARNPC1
SCHEMBL10375262 0.86 KMT2A (0.41) KMT2AMEN1ALDH1A1ARNPC1
SCHEMBL10375282 0.84 ALDH1A1 (0.55) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL10375434 0.82 ALDH1A1 (0.50) KMT2AALDH1A1LMNACYP2D6MAPK1
SCHEMBL10375532 0.81 KMT2A (0.51) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL10375437 0.81 MAPT (0.42) KMT2AMEN1ALDH1A1RAB9AABCG2
SCHEMBL10375516 0.80 KDM4E (0.54) KMT2AMEN1ALDH1A1ARNPC1
SCHEMBL4460195 0.79 PLA2G2A (0.53) KMT2AMEN1ALDH1A1RAB9APLA2G2A
SCHEMBL10375294 0.79 KMT2A (0.48) KMT2AMEN1ALDH1A1NPC1RAB9A

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