SCHEMBL10575968

SCHEMBL10575968

Clc1nc(-c2ccccc2)nc2c1SCCC2

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 10/20 0.50
▸ PDE4D Q08499 10/20 0.50
▸ MEN1 O00255 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ LMNA P02545 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TNKS2 Q9H2K2 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TP53 P04637 1/20 0.37

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
SCHEMBL14095085 0.77 MEN1 (0.38) PDE4BPDE4DMEN1HTTKMT2A
SCHEMBL10570359 0.75 HTR2C (0.42) PDE4BPDE4DMEN1KMT2ALMNA
SCHEMBL2273843 0.74 LMNA (0.52) PDE4BMEN1HTTKMT2ALMNA
SCHEMBL2624086 0.74 LMNA (0.56) PDE4BMEN1HTTKMT2ALMNA
SCHEMBL9384614 0.74 TNKS (0.31) PDE4BPDE4DTNKS2
SCHEMBL27851793 0.73 TNKS2 (0.44) PDE4BPDE4DMEN1HTTKMT2A
Hydrochloric Acid SCHEMBL10574016 0.72 PRKCI (0.47) PDE4BPDE4DLMNATP53
SCHEMBL15659115 0.72 PDE4B (0.42) PDE4BPDE4D
SCHEMBL10575470 0.72 PDE4B (0.44) PDE4BPDE4DMEN1KMT2ATP53
SCHEMBL11035315 0.70 KDM4E (0.35) PDE4BPDE4DTDP1TNKS2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4871739-A Substituted 6H-7,8-dihydrothiapyrano(3,2-D)-pyrimidines as hyopglycemic agents MERCK & CO., INC. (US) 1989-10-03 — — US disclosed
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