SCHEMBL8505395

SCHEMBL8505395

Cn1c(Cl)c(C=O)c2cccc(Cl)c21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ ATM Q13315 1/20 0.44
▸ NPSR1 Q6W5P4 7/20 0.38
▸ MAPT P10636 6/20 0.38
▸ HTT P42858 4/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ NOD2 Q9HC29 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ HPGD P15428 2/20 0.37
▸ PRMT5 O14744 1/20 0.37
▸ PSMB8 P28062 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ CYP2A6 P11509 1/20 0.35

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
SCHEMBL29374992 0.75 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AATMNPSR1
SCHEMBL1092518 0.75 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AATMNPSR1
SCHEMBL11503490 0.72 NQO2 (0.64) ALDH1A1MEN1KMT2ATDP1ATM
SCHEMBL1094078 0.70 ALKBH5 (0.49) ALDH1A1MEN1KMT2ANPSR1MAPT
SCHEMBL29956951 0.70 FEN1 (0.45) ALDH1A1MEN1KMT2AATMNPSR1
SCHEMBL838056 0.69 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ATDP1ATM
SCHEMBL3269148 0.68 MEN1 (0.52) ALDH1A1MEN1KMT2ATDP1ATM
SCHEMBL8503543 0.68 MEN1 (0.43) MEN1KMT2ATDP1ATMNPSR1
SCHEMBL96214 0.68 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ATDP1NPSR1
SCHEMBL910073 0.67 ALDH1A1 (0.70) ALDH1A1MEN1KMT2ATDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0750621-B1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1999-07-21 — — EP disclosed
US-5783575-A CENTRAL NERVOUS SYSTEM DISORDERS NOVO NORDISK A/S (DK) 1998-07-21 — — US disclosed
EP-0750621-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1997-01-02 — — EP disclosed
US-5536721-A Thieno[2,3-b-indole derivatives and their use for treating central nervous system diseases related to the metabotropic glutamate receptor system NOVO NORDISK A/S (DK) 1996-07-16 — — US disclosed
WO-1995025110-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1995-09-21 — — WO disclosed
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