SCHEMBL9864982

SCHEMBL9864982

Cc1ccc2c(c1)C1=NN(c3ccc(O)cc3)C(=O)CC1CS2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 3/20 0.40
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
MAP3K7 O43318 1/20 0.36
TAB1 Q15750 1/20 0.36
MAOB P27338 1/20 0.33
PRKCZ Q05513 2/20 0.33
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32

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
SCHEMBL10558711 0.89 MAPT (0.43) KDM4ESMN1; SMN2MAPTNPSR1LMNA
SCHEMBL10560169 0.88 KDM4E (0.37) KDM4ESMN1; SMN2MAP3K7TAB1MAOB
SCHEMBL10564407 0.87 APP (0.43) KDM4ESMN1; SMN2MAPTNPSR1LMNA
SCHEMBL9866556 0.86 PRKCZ (0.38) KDM4ESMN1; SMN2MAPTNPSR1LMNA
SCHEMBL9601585 0.85 MIF (0.36) KDM4ESMN1; SMN2MAPTMAP3K7TAB1
SCHEMBL7297497 0.83 MAOA (0.33) KDM4ESMN1; SMN2MAPTNPSR1LMNA
SCHEMBL10570570 0.82 KDM4E (0.37) KDM4ESMN1; SMN2MAPTNPSR1LMNA
SCHEMBL10560355 0.81 HTT (0.38) KDM4ESMN1; SMN2MAPTHTTRAB9A
SCHEMBL10556208 0.81 MAPT (0.40) KDM4ESMN1; SMN2MAPTNPSR1LMNA
SCHEMBL10560262 0.80 APP (0.42) KDM4ESMN1; SMN2MAPTLMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 US disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 EP disclosed