SCHEMBL7710281

SCHEMBL7710281

Cc1c(-c2c[nH]c3ccccc23)nc2ccccc2c1C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.74
KMT2A Q03164 2/20 0.64
TSHR P16473 1/20 0.62
DHODH Q02127 7/20 0.59
MEN1 O00255 1/20 0.54
MAPT P10636 2/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
GPR55 Q9Y2T6 1/20 0.51
KDM4E B2RXH2 1/20 0.47
TUBB4A P04350 1/20 0.47
TUBB P07437 1/20 0.47
TUBA3C P0DPH7 1/20 0.47

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
SCHEMBL1581468 0.77 PDE10A (1.00) PDE10AKMT2ATSHRDHODHLMNA
Hydrochloric Acid SCHEMBL27511204 0.76 PDE10A (0.97) PDE10AKMT2ATSHRDHODHLMNA
SCHEMBL2956896 0.75 MAPT (0.64) PDE10AKMT2AMEN1MAPTALDH1A1
SCHEMBL27710092 0.73 PDE10A (0.49) PDE10AKMT2AMEN1MAPTALDH1A1
SCHEMBL17175790 0.73 PDE10A (0.62) PDE10AKMT2AMEN1MAPTALDH1A1
SCHEMBL13957825 0.72 PDE10A (1.00) PDE10AKMT2ATSHRDHODHMEN1
SCHEMBL1902587 0.71 MEN1 (1.00) PDE10AKMT2AMEN1MAPTALDH1A1
Methylene Chloride SCHEMBL30760638 0.71 MAPT (0.58) PDE10AKMT2AMEN1MAPTALDH1A1
SCHEMBL14106730 0.70 PDE10A (0.72) PDE10AKMT2ATSHRDHODHMEN1
SCHEMBL7715419 0.70 KDM4E (0.81) PDE10AKMT2ADHODHMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6376670-B1 BACTERICIDE FOR GRAMPOSITIVE BACTERIA SEPRACOR INC. 2002-04-23 US disclosed
US-6207679-B1 FOR INHIBITING GROWTH OF BACTERIAL MICROORGANISMS SEPRACOR, INC. 2001-03-27 US disclosed
US-6172084-B1 BACTERICIDES AGAINST ANTIBIOTIC RESISTANT STRAINS OF STAPHYLOCOCCUS, STREPTOCOCCUS AND ENTEROCOCCUS SEPRACOR, INC. 2001-01-09 US disclosed
US-6103905-A EFFECTIVE AGAINST DRUG RESISTANT GRAMPOSITIVE BACTERIAL INFECTIONS; ANTIBIOTICS SEPRACOR, INC. (US) 2000-08-15 US disclosed
WO-2000034265-A2 QUINOLINE-INDOLE ANTIMICROBIAL AGENTS SEPRACOR, INC. (US) 2000-06-15 WO disclosed
EP-0991623-A2 QUINOLINE-INDOLE ANTIMICROBIAL AGENTS, USES AND COMPOSITIONS RELATED THERETO SEPRACOR, INC. (US) 2000-04-12 EP disclosed
WO-1998057931-A2 QUINOLINE-INDOLE ANTIMICROBIAL AGENTS, USES AND COMPOSITIONS RELATED THERETO SEPRACOR INC. (US) 1998-12-23 WO disclosed