SCHEMBL7436181

SCHEMBL7436181

O=C1CC(Cc2ccccc2)CN1Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.62
TSHR P16473 1/20 0.62
DPP4 P27487 2/20 0.51
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48
CCR3 P51677 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 1/20 0.46
HTT P42858 1/20 0.46
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
GLA P06280 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL9456344 0.87 HPGD (0.62) HPGDTSHRDPP4PDE4APDE4B
SCHEMBL3124428 0.85 HPGD (0.60) HPGDTSHRDPP4PDE4APDE4B
Nebracetam SCHEMBL195354 0.85 HPGD (0.60) HPGDTSHRDPP4PDE4APDE4B
SCHEMBL21704253 0.85 HPGD (0.60) HPGDTSHRDPP4PDE4APDE4B
SCHEMBL20722377 0.85 HPGD (0.60) HPGDTSHRDPP4PDE4APDE4B
SCHEMBL3240700 0.85 HPGD (0.60) HPGDTSHRDPP4PDE4APDE4B
SCHEMBL13036597 0.85 HPGD (0.60) HPGDTSHRDPP4PDE4APDE4B
SCHEMBL15291862 0.84 HPGD (0.59) HPGDTSHRDPP4PDE4APDE4B
SCHEMBL7442618 0.84 CCR3 (0.57) HPGDTSHRCCR3ALDH1A1KMT2A
SCHEMBL9437301 0.83 HPGD (0.57) HPGDTSHRDPP4PDE4APDE4B

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-6066666-A OPTIONALLY N-SUBSTITUTED 3-MONO- AND DI-SUBSTITUTED 2-PYRROLIDINONES AND THIOLACTAM ANALOGS; TREAT SEIZURES, ANXIETY, AND ENHANCING 4-AMINOBUTYRIC ACID (GABA)-INDUCED CHLORIDE CURRENTS AT GABA RECEPTOR/IONOPHORE COMPLEX WASHINGTON UNIVERSITY (US) 2000-05-23 US disclosed
US-5776959-A Anticonvulsant and anxiolytic lactam and thiolactam derivatives WASHINGTON UNIVERSITY (US) 1998-07-07 US disclosed