SCHEMBL9197399

SCHEMBL9197399

CCC1C(C(=O)O)C(=O)CCN1C(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 3/20 0.41
ABCG2 Q9UNQ0 2/20 0.41
BLM P54132 1/20 0.41
TSHR P16473 1/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACHE P22303 1/20 0.39
CNR2 P34972 2/20 0.39
CNR1 P21554 1/20 0.39
PARP1 P09874 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
MTNR1B P49286 1/20 0.38

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
SCHEMBL9295024 0.82 ACHE (0.45) ABCB1ABCG2TSHRRECQLSMN1; SMN2
Hydrochloric Acid SCHEMBL4364214 0.75 TACR1 (0.40)
SCHEMBL9220425 0.73 L3MBTL1 (0.45) ABCB1ABCG2TSHRRECQLSMN1; SMN2
SCHEMBL3842028 0.71 PSEN1 (0.46) ABCB1ABCG2BLMTSHRRECQL
SCHEMBL5544976 0.70 ACHE (0.45) ABCB1ABCG2TSHRRECQLSMN1; SMN2
SCHEMBL13385223 0.68 CNR2 (0.53) CNR2CNR1
SCHEMBL2887859 0.68 CNR2 (0.53) TSHRCNR2CNR1
SCHEMBL2887853 0.68 CNR2 (0.53) TSHRCNR2CNR1
SCHEMBL8253035 0.67 NPC1 (0.54) ACHEL3MBTL1
SCHEMBL8243019 0.67 NPC1 (0.54) ACHEL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0360293-B1 Process for the preparation of 4,5,6,7-tetrahydrothieno[3,2-c]pyridines LONZA AG (CH) 1995-08-30 EP disclosed
US-4990618-A Process for the production of 4,5,6,7-tetrahydrothieno-[3,2-c]-pyridines LONZA LTD. (CH) 1991-02-05 US disclosed
US-4965359-A Process for the production of 4,5,6,7-tetrahydrothieno-[3,2-C]-pyridines LONZA LTD. (CH) 1990-10-23 US disclosed