SCHEMBL9846175

SCHEMBL9846175

CCc1cc(NCc2nc(C)ccc2OC)c(=O)[nH]c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 5/20 0.38
PDE3A Q14432 5/20 0.38
MAPT P10636 5/20 0.36
KDM4E B2RXH2 4/20 0.36
APAF1 O14727 1/20 0.36
RECQL P46063 1/20 0.36
PDE10A Q9Y233 2/20 0.36
MAPK1 P28482 3/20 0.35
GAA P10253 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
POLB P06746 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
CCNE2 O96020 2/20 0.35
CCNE1 P24864 2/20 0.35
CDK2 P24941 2/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
LMNA P02545 2/20 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
SCHEMBL9846203 0.86 PDE3B (0.38) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9846298 0.84 PDE3B (0.38) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL27337641 0.80 POLB (0.49) PDE3BPDE3AMAPTKDM4EGAA
SCHEMBL9278136 0.80 MAPT (0.51) PDE3BPDE3AMAPTKDM4EMAPK1
SCHEMBL9846183 0.79 RXFP1 (0.38) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9164330 0.79 MAPT (0.41) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9170296 0.78 KDM4E (0.44) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9846107 0.78 PDE3B (0.41) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9846383 0.77 PDE3B (0.43) PDE3BPDE3AMAPTKDM4EAPAF1
SCHEMBL9283645 0.77 MAPT (0.48) PDE3BPDE3AMAPTKDM4EAPAF1

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-0462800-A2 Inhibitors of HIV reverse transcriptase MERCK & CO. INC. (US) 1991-12-27 EP disclosed