SCHEMBL7489095

SCHEMBL7489095

O=C(O)N1CCC(CCn2c(-c3ccccc3)nc3c(C(F)(F)F)nc4ccccc4c32)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.38
PTGER4 P35408 1/20 0.37
RBP4 P02753 1/20 0.36
HRH3 Q9Y5N1 3/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TLR7 Q9NYK1 2/20 0.35
CKS1B P61024 1/20 0.35
SKP1 P63208 1/20 0.35
SKP2 Q13309 1/20 0.35
BRD4 O60885 1/20 0.35
RXFP1 Q9HBX9 3/20 0.34
HTR2B P41595 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL6838066 0.93 BRD4 (0.43) TRPV1PTGER4HRH3TSHRBRD4
SCHEMBL6833883 0.89 KDM4E (0.42) CKS1BSKP1SKP2TP53
SCHEMBL6928550 0.87 PTGER4 (0.40) PTGER4HRH3ALDH1A1TSHRSMN1; SMN2
SCHEMBL6833951 0.87 PTGER4 (0.38) PTGER4HRH3ALDH1A1TSHRSMN1; SMN2
SCHEMBL6837624 0.85 ACHE (0.47)
SCHEMBL6833713 0.84 NPY1R (0.39) TLR7
SCHEMBL6929687 0.84 KDM4E (0.39) PTGER4HRH3ALDH1A1TSHRTLR7
SCHEMBL6834046 0.84 PTGER4 (0.36) PTGER4HRH3ALDH1A1TSHRSMN1; SMN2
SCHEMBL6840051 0.83 P2RX3 (0.34) PTGER4TSHRSMN1; SMN2BRD4
SCHEMBL6929280 0.83 KDM4E (0.43) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1256582-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2002-11-13 EP disclosed