SCHEMBL7652765

SCHEMBL7652765

Cc1ccc(Cl)cc1N1CCCN(C2CCC2)C1=S

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 3/20 0.39
GAA P10253 2/20 0.39
TSHR P16473 2/20 0.39
NR1H4 Q96RI1 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.38
CNR1 P21554 1/20 0.38
HTT P42858 2/20 0.38
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
USP2 O75604 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
TP53 P04637 1/20 0.35
ADAMTS5 Q9UNA0 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
SCHEMBL7649121 0.79 ALDH1A1 (0.45) ALDH1A1MEN1KMT2ANPSR1LMNA
SCHEMBL7650742 0.76 MEN1 (0.42) ALDH1A1MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL7655761 0.76 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL7652054 0.74 MEN1 (0.40) ALDH1A1MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL7653880 0.72 MEN1 (0.39) ALDH1A1MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL8525303 0.70 NPSR1 (0.48) ALDH1A1MEN1KMT2ANPSR1POLB
SCHEMBL7652026 0.68 AKR1C3 (0.40) ALDH1A1MEN1KMT2ANPSR1POLB
SCHEMBL16574014 0.67 HSD17B10 (0.54) ALDH1A1MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL8119583 0.65 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ANPSR1POLB
SCHEMBL14013835 0.65 ALDH1A1 (0.67) ALDH1A1MEN1KMT2ANPSR1POLB

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
US-6340687-B1 ELEVATE HIGH DENSITY LIPOPROTEIN CHOLESTEROL CONCENTRATION AMERICAN HOME PRODUCTS CORPORATION 2002-01-22 US claimed
WO-1999011630-A1 SUBSTITUTED TETRAHYDRO-PYRIMIDINE-2(1H)-THIONE HDL-C ELEVATORS USEFUL AS ANTIATHEROSCLEROTIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-03-11 WO claimed
US-6340687-B1 ELEVATE HIGH DENSITY LIPOPROTEIN CHOLESTEROL CONCENTRATION AMERICAN HOME PRODUCTS CORPORATION 2002-01-22 US disclosed