SCHEMBL8322672

SCHEMBL8322672

CN(CCO)CCNC(=O)C[O]

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.37
KDM4E B2RXH2 1/20 0.33
LGALS1 P09382 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
NAAA Q02083 1/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ACKR3 P25106 1/20 0.31
TMEM97 Q5BJF2 1/20 0.30
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL9003285 0.86 DNM1 (0.38) DNM1KDM4ELGALS1MEN1KMT2A
SCHEMBL8323458 0.85 DNM1 (0.42) DNM1LGALS1MEN1KMT2ANAAA
SCHEMBL8323460 0.84 NAAA (0.48) DNM1LGALS1MEN1KMT2ANAAA
SCHEMBL7778639 0.79 CA12 (0.35) DNM1KDM4EKMT2ANAAAMAPT
SCHEMBL9547380 0.79 KDM4E (0.44) KDM4EALDH1A1
SCHEMBL25204410 0.79 MAPT (0.35) DNM1KDM4EMEN1KMT2AMAPT
SCHEMBL1387313 0.79 DNM1 (0.55) DNM1LGALS1ALDH1A1ACKR3
SCHEMBL8316747 0.78 LGALS1 (0.36) DNM1LGALS1MEN1KMT2AMAPT
SCHEMBL14436497 0.78 MAPT (0.33) DNM1MEN1KMT2AMAPT
SCHEMBL9547373 0.78 MAPT (0.33) DNM1MEN1KMT2AMAPT

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
US-5880130-A TREATMENT OF CELL-PROLIFERATION DISEASES ZENECA LIMITED (GB) 1999-03-09 US disclosed
EP-0733045-A1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ZENECA LIMITED (GB) 1996-09-25 EP disclosed
WO-1995015952-A1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ZENECA LIMITED (GB) 1995-06-15 WO disclosed