SCHEMBL7397754

SCHEMBL7397754

O=C(O)[C]1C2CCCC1CCC2

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.41
ACMSD Q8TDX5 2/20 0.36
KMO O15229 2/20 0.36
KDM4E B2RXH2 2/20 0.35
HTT P42858 2/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
GLA P06280 1/20 0.35
HIF1A Q16665 1/20 0.35
OAT P04181 1/20 0.32
HCAR3 P49019 1/20 0.31
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL7401851 0.69 TSHR (0.50) KDM4EKMT2A
SCHEMBL1264771 0.67 ACMSD (0.38) HCAR2ACMSDKMOKDM4EHTT
SCHEMBL13266972 0.66 HDAC8 (0.58) ACMSDKMOKDM4EHTTKMT2A
SCHEMBL16577394 0.65 HCAR2 (0.38) HCAR2ACMSDKMOOATPOLB
SCHEMBL24087489 0.64 HDAC8 (0.56) ACMSDKMOKDM4EHTTKMT2A
Bicarbonate SCHEMBL11121465 0.64 AKR1C3 (0.53) KMOSMN1; SMN2
SCHEMBL275220 0.61 AKR1C3 (0.37) HCAR2KMT2APOLB
SCHEMBL10764783 0.61 AKR1C3 (0.37) HCAR2KMT2APOLB
SCHEMBL7860288 0.61 AKR1C3 (0.37) HCAR2KMT2APOLB
SCHEMBL14787795 0.60 MAOA (0.35) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5965579-A ANTAGONISTS OF THE NEUROTENSIN RECEPTORS; INCREASING AFFINITY FOR HUMAN NEUROTENSIN RECEPTORS SANOFI (FR) 1999-10-12 US claimed
EP-1097921-A1 Phenylhydrazines SANOFI-SYNTHELABO (FR) 2001-05-09 EP disclosed
US-6172239-B1 PSYCHOLOGICAL, NERVOUS SYSTEM DISORDERS SANOFI (FR) 2001-01-09 US disclosed
US-5965579-A ANTAGONISTS OF THE NEUROTENSIN RECEPTORS; INCREASING AFFINITY FOR HUMAN NEUROTENSIN RECEPTORS SANOFI (FR) 1999-10-12 US disclosed
EP-0820444-A1 1-PHENYLPYRAZOLE-3-CARBOXAMIDES ACTING ON NEUROTENSIN RECEPTORS SANOFI (FR) 1998-01-28 EP disclosed
WO-1996032382-A1 1-PHENYLPYRAZOLE-3-CARBOXAMIDES ACTING ON NEUROTENSIN RECEPTORS SANOFI (FR) 1996-10-17 WO disclosed