SCHEMBL19343957

SCHEMBL19343957

CSc1ncnn2c(C3O[C@H](COCc4ccccc4)C[C@H]3OCc3ccccc3)ccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 1/20 0.34
▸ BCHE P06276 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ HRH4 Q9H3N8 4/20 0.32
▸ HRH3 Q9Y5N1 4/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ DRD1 P21728 1/20 0.31
▸ PDE2A O00408 1/20 0.31
▸ TSHR P16473 1/20 0.30
▸ CASP3 P42574 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SENP8 Q96LD8 1/20 0.30
▸ SENP7 Q9BQF6 1/20 0.30
▸ SENP6 Q9GZR1 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ SSTR1 P30872 1/20 0.30
▸ SSTR2 P30874 1/20 0.30
▸ SSTR4 P31391 1/20 0.30
▸ SSTR3 P32745 1/20 0.30

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
SCHEMBL25948690 0.83 HRH4 (0.45) HRH4HRH3LMNADRD1PDE2A
SCHEMBL23584542 0.83 HRH4 (0.45) HRH4HRH3LMNADRD1PDE2A
SCHEMBL19343951 0.82 HTR1A (0.41) BCHEHTR1APDE2ASSTR1SSTR2
SCHEMBL22002160 0.82 HTR1A (0.41) BCHEHTR1APDE2ASSTR1SSTR2
SCHEMBL17106780 0.82 HTR1A (0.41) BCHEHTR1APDE2ASSTR1SSTR2
SCHEMBL29937697 0.82 HTR1A (0.41) BCHEHTR1APDE2ASSTR1SSTR2
SCHEMBL17106778 0.82 HTR1A (0.41) BCHEHTR1APDE2ASSTR1SSTR2
SCHEMBL22434962 0.76 HSPA5 (0.32) HTR1A
SCHEMBL18666890 0.76 HSPA5 (0.36) HRH4HRH3LMNAHTR1ADRD1
SCHEMBL22569894 0.76 HRH4 (0.34) HRH4HRH3LMNAPDE2A

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
WO-2017153186-A1 SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2017-09-14 — — WO disclosed
Send feedback