SCHEMBL8699306

SCHEMBL8699306

CCc1cc(NC(=O)N2CCN(c3cc(F)cc(F)c3)CC2)c(OC)nc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.42
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 5/20 0.42
RBP4 P02753 1/20 0.41
HSD17B10 Q99714 3/20 0.41
TP53 P04637 3/20 0.41
LMNA P02545 3/20 0.41
POLB P06746 2/20 0.41
USP2 O75604 2/20 0.41
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 3/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
MAPK1 P28482 2/20 0.39
HTR1A P08908 1/20 0.39
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39
HTR2A P28223 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
SCHEMBL6966760 0.93 MAPT (0.40) MAPTKDM4EALDH1A1RBP4HSD17B10
SCHEMBL8704891 0.91 MAPT (0.53) MAPTKDM4EALDH1A1RBP4HSD17B10
SCHEMBL6956284 0.90 RBP4 (0.43) MAPTKDM4EALDH1A1RBP4HSD17B10
SCHEMBL6654791 0.89 PHGDH (0.43) MAPTKDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL8699435 0.89 RBP4 (0.49) MAPTKDM4EALDH1A1RBP4HSD17B10
SCHEMBL6960671 0.89 KMT2A (0.47) MAPTKDM4EALDH1A1RBP4HSD17B10
SCHEMBL8699252 0.89 MAPT (0.44) MAPTKDM4EALDH1A1RBP4HSD17B10
SCHEMBL6671809 0.87 ALDH1A1 (0.36) MAPTALDH1A1HSD17B10LMNASMN1; SMN2
SCHEMBL8704045 0.87 RBP4 (0.45) MAPTKDM4EALDH1A1RBP4HSD17B10
SCHEMBL8703929 0.87 RBP4 (0.47) MAPTKDM4EALDH1A1RBP4HSD17B10

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
US-5780472-A ANTITUMOR AGENTS SAMJIN PHARMACEUTICAZL CO., LTD. (KR) 1998-07-14 US disclosed
WO-1996021648-A1 NEW PIPERAZINE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME SAMJIN PHARMACEUTICAL CO., LTD. (KR) 1996-07-18 WO disclosed