SCHEMBL19365595

SCHEMBL19365595

C[C@@H]1CCN(C)c2ccc(-c3cccc(C(F)(F)F)c3)nc2N1C(=O)Nc1cncc(F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.38
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ HTR2C P28335 4/20 0.36
▸ HTR2A P28223 3/20 0.36
▸ FYN P06241 1/20 0.36
▸ HTR2B P41595 3/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ JAK2 O60674 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35
▸ CYP1A2 P05177 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
SCHEMBL19365708 0.91 MAPT (0.41) MAPTCA2CA9MEN1KMT2A
SCHEMBL19365254 0.90 HTR2C (0.47) MAPTMEN1KMT2ASMN1; SMN2HTR2C
SCHEMBL19365904 0.89 MAPT (0.43) MAPTCA2CA9MEN1KMT2A
SCHEMBL19365507 0.87 MAPT (0.37) MAPTCA2CA9MEN1KMT2A
SCHEMBL19364877 0.87 TRPV3 (0.38) MAPTSMN1; SMN2JAK2ALDH1A1
SCHEMBL19670246 0.86 SCN9A (0.39) MAPTCA2CA9FYNKDM1A
SCHEMBL19365440 0.85 PIM2 (0.35) MEN1KMT2AHTR2CHTR2AHTR2B
SCHEMBL19365498 0.85 HTR2C (0.46) MAPTMEN1KMT2ASMN1; SMN2HTR2C
SCHEMBL19365678 0.85 PDE10A (0.34) MEN1KMT2AHTTHTR2CHTR2A
SCHEMBL19365433 0.85 PDE10A (0.34) MEN1KMT2AHTTHTR2CHTR2A

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
US-9765075-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-09-19 — — US disclosed
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