SCHEMBL9565728

SCHEMBL9565728

CN1C(=O)CC(=O)N(c2ccc(Cl)cc2)C1=O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.55
PDE4D Q08499 1/20 0.55
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
ELANE P08246 2/20 0.47
MGLL Q99685 1/20 0.47
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
ALDH1A1 P00352 4/20 0.45
MAPT P10636 3/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALOX12 P18054 1/20 0.43
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 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
SCHEMBL8123624 0.88 MEN1 (0.61) OPRK1PDE4DMEN1KMT2AELANE
SCHEMBL5443754 0.83 ELANE (0.57) OPRK1PDE4DMEN1KMT2AELANE
SCHEMBL5437358 0.83 OPRK1 (0.56) OPRK1PDE4DMEN1KMT2AMGLL
SCHEMBL9230907 0.83 OPRK1 (0.57) OPRK1PDE4DMEN1KMT2AMGLL
SCHEMBL9565725 0.81 MEN1 (0.49) OPRK1PDE4DMEN1KMT2AMGLL
SCHEMBL11785882 0.81 MAPT (0.44) OPRK1PDE4DMEN1KMT2AELANE
SCHEMBL11656315 0.81 KMT2A (0.53) OPRK1PDE4DMEN1KMT2AALDH1A1
SCHEMBL11745569 0.79 MGLL (0.53) OPRK1PDE4DMEN1KMT2AMGLL
SCHEMBL11160362 0.78 MEN1 (0.44) OPRK1PDE4DMEN1KMT2AELANE
SCHEMBL10858522 0.78 ELANE (0.47) MEN1KMT2AELANEMGLLCYP1A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0546661-A1 Pyrimidine derivatives, method for preparation thereof and pharmaceutical composition having said derivatives as active elements JAPAN ENERGY CORPORATION (JP) 1993-06-16 EP disclosed
US-4399280-A MOTHPROOFING, PROTECTION OF KERATINOUS MATERIAL CIBA-GEIGY CORPORATION (US) 1983-08-16 US disclosed
US-4283444-A MOTHPROOFING WOOLS, FURS, SKINS CIBA-GEIGY CORPORATION (US) 1981-08-11 US disclosed
US-4097475-A FOR POLYESTERS AND BLENDS WITH CELLULOSE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-06-27 US disclosed