SCHEMBL6964018

SCHEMBL6964018

C=C(C)c1ccccc1N1CCN(C(=O)Nc2cc(C)c(C)nc2OC)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
RBP4 P02753 2/20 0.46
PANK3 Q9H999 1/20 0.45
MAPT P10636 4/20 0.44
RAB9A P51151 1/20 0.44
HTR1A P08908 3/20 0.43
HTR1D P28221 3/20 0.43
HTR1B P28222 3/20 0.43
LMNA P02545 3/20 0.43
MAPK1 P28482 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
TRPV1 Q8NER1 3/20 0.41
GAA P10253 2/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR7 P34969 1/20 0.41
HTR6 P50406 1/20 0.41
MEN1 O00255 1/20 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
SCHEMBL6963379 0.90 RBP4 (0.46) KMT2AL3MBTL1RBP4PANK3MAPT
SCHEMBL6966645 0.86 MAPT (0.60) KMT2ARBP4MAPTRAB9AHTR1A
SCHEMBL9058218 0.85 PANK3 (0.62) KMT2AL3MBTL1RBP4PANK3MAPT
SCHEMBL8700515 0.84 KDM4E (0.48) KMT2AL3MBTL1RBP4PANK3MAPT
SCHEMBL6962308 0.84 RBP4 (0.56) KMT2AL3MBTL1RBP4PANK3MAPT
SCHEMBL8705827 0.84 LMNA (0.61) KMT2AL3MBTL1RBP4MAPTRAB9A
SCHEMBL6966961 0.83 RBP4 (0.46) KMT2AL3MBTL1RBP4PANK3MAPT
SCHEMBL8094380 0.83 RBP4 (0.46) KMT2AL3MBTL1RBP4PANK3MAPT
SCHEMBL8699977 0.83 MAPT (0.48) KMT2AL3MBTL1RBP4PANK3MAPT
SCHEMBL6652808 0.83 RBP4 (0.57) KMT2AL3MBTL1RBP4MAPTHTR1A

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
EP-0850222-B1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARM CO LTD (KR) 2003-05-28 EP disclosed
US-6028195-A AN ANTITUMOR AGENT WITH VERY LOW TOXICITIES SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-02-22 US disclosed