SCHEMBL171437

SCHEMBL171437

CCOc1ccc(C2=CCCN2C(=O)O)nc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 4/20 0.38
HPGD P15428 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HSD17B10 Q99714 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37
ACACB O00763 4/20 0.36
GAA P10253 1/20 0.36
FKBP1A P62942 1/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL13490381 0.78 KDM4E (0.39) P4HTMALDH1A1KMT2ASMN1; SMN2KDM4E
SCHEMBL31692110 0.70 NQO1 (0.59) P4HTMALDH1A1MAPTKMT2ASMN1; SMN2
SCHEMBL18589251 0.65 CYP4F2 (0.48) P4HTMALDH1A1MAPTKMT2ASMN1; SMN2
SCHEMBL1403507 0.65 P4HTM (0.63) P4HTMALDH1A1MAPTKMT2AKDM4E
SCHEMBL28370402 0.63 MEN1 (0.47) ALDH1A1MAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL5104455 0.62 KMT2A (0.46) ALDH1A1MAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL34470178 0.62 IKBKE (0.43) P4HTMALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL34470138 0.61 DHODH (0.42) P4HTMALDH1A1MAPTKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL5104753 0.61 KMT2A (0.45) ALDH1A1MAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL18496839 0.60 P4HTM (0.47) P4HTMALDH1A1KMT2ASMN1; SMN2KDM4E

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-2426120-A1 Pyridyltetrahydropyridines and pyridylpiperidines, and method of manufacturing them Fujifilm Finechemicals Co., Ltd. (JP) 2012-03-07 EP disclosed