SCHEMBL7757668

SCHEMBL7757668

CCc1c(Oc2cc(C)cc(C)c2)n(C/C=C\c2ccccc2)c(=O)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
USP2 O75604 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 3/20 0.34
TK1 P04183 4/20 0.33
KMT2A Q03164 2/20 0.33
PPARG P37231 1/20 0.33
KDM4E B2RXH2 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
BRD4 O60885 1/20 0.33
BRDT Q58F21 1/20 0.33
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7757681 1.00 TP53 (0.35) TP53MAPTALDH1A1LMNAUSP2
SCHEMBL7759865 1.00 TP53 (0.35) TP53MAPTALDH1A1LMNAUSP2
SCHEMBL7756725 0.85 SMN1; SMN2 (0.35) TP53MAPTALDH1A1LMNATSHR
SCHEMBL7758798 0.85 SMN1; SMN2 (0.35) MAPTALDH1A1TK1KMT2AKDM4E
SCHEMBL7758804 0.85 SMN1; SMN2 (0.35) MAPTALDH1A1TK1KMT2AKDM4E
SCHEMBL7759888 0.85 SMN1; SMN2 (0.35) TP53MAPTALDH1A1LMNATSHR
SCHEMBL7756730 0.85 SMN1; SMN2 (0.35) TP53MAPTALDH1A1LMNATSHR
SCHEMBL7757657 0.84 TSHR (0.36) TP53MAPTALDH1A1LMNAUSP2
SCHEMBL7757660 0.84 TSHR (0.36) TP53MAPTALDH1A1LMNAUSP2
SCHEMBL7757642 0.83 SMN1; SMN2 (0.33) MAPTALDH1A1TK1KMT2AKDM4E

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-0736015-B1 ANTIVIRAL 2,4-PYRIMIDINDIONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RES INST CHEM TECH (KR) 2001-03-07 EP disclosed
US-5747500-A VIRICIDES FOR AIDS KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1998-05-05 US disclosed
WO-1995018109-A1 NOVEL ANTIVIRAL 2,4-PYRIMIDINEDIONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-07-06 WO disclosed