SCHEMBL10608979

SCHEMBL10608979

CN(C(=O)COc1cc(-c2ccccc2)nc2ccccc12)C1CCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
ALDH1A1 P00352 2/20 0.53
POLB P06746 1/20 0.51
LMNA P02545 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HPGD P15428 2/20 0.48
ACP1 P24666 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RAB9A P51151 3/20 0.45
ACACA Q13085 1/20 0.45
KDM4E B2RXH2 1/20 0.44
TSHR P16473 1/20 0.44
HTR3E A5X5Y0 1/20 0.44
HTR3B O95264 1/20 0.44
HTR3A P46098 1/20 0.44
HTR3D Q70Z44 1/20 0.44
HTR3C Q8WXA8 1/20 0.44

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
SCHEMBL10610967 0.85 SMN1; SMN2 (0.56) ALDH1A1POLBLMNASMN1; SMN2HPGD
SCHEMBL10613436 0.84 HPGD (0.47) ALDH1A1LMNASMN1; SMN2HPGDACP1
Hydrochloric Acid SCHEMBL10612190 0.83 HPGD (0.46) ALDH1A1LMNASMN1; SMN2HPGDACP1
SCHEMBL10610777 0.82 MEN1 (0.56) ALDH1A1LMNASMN1; SMN2HPGDACP1
SCHEMBL10613503 0.81 SMN1; SMN2 (0.51) ALDH1A1LMNASMN1; SMN2HPGDACP1
SCHEMBL10610594 0.81 TSHR (0.52) ALDH1A1LMNASMN1; SMN2HPGDACP1
SCHEMBL10611075 0.81 KDM4E (0.58) ALDH1A1POLBLMNASMN1; SMN2HPGD
SCHEMBL10609061 0.80 SMN1; SMN2 (0.54) ALDH1A1LMNASMN1; SMN2HPGDMEN1
SCHEMBL10613512 0.79 SMN1; SMN2 (0.49) ALDH1A1LMNASMN1; SMN2HPGDACP1
SCHEMBL10610248 0.78 ACACA (0.67) ALDH1A1LMNASMN1; SMN2HPGDACP1

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-4728647-A Amides derived from quinoline, and anxiolytic compositions containing them RHONE-POULENC SANTE (FR) 1988-03-01 US claimed
US-4728647-A Amides derived from quinoline, and anxiolytic compositions containing them RHONE-POULENC SANTE (FR) 1988-03-01 US disclosed