SCHEMBL9624779

SCHEMBL9624779

Cc1cc2c(cc1C)C(=S)N(CCCN(C)CCCCc1cccs1)C2

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
ALDH1A1 P00352 5/20 0.36
POLB P06746 2/20 0.36
KMT2A Q03164 2/20 0.35
GPR55 Q9Y2T6 1/20 0.33
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32

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
SCHEMBL9624961 0.97 LMNA (0.39) LMNAL3MBTL1PTGS1PTGS2ALDH1A1
SCHEMBL9625079 0.95 LMNA (0.39) LMNAL3MBTL1PTGS1PTGS2ALDH1A1
SCHEMBL9624441 0.88 L3MBTL1 (0.37) LMNAL3MBTL1PTGS1PTGS2ALDH1A1
SCHEMBL9623637 0.87 SMN1; SMN2 (0.37) LMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL9624617 0.87 ALDH1A1 (0.41) LMNAALDH1A1SMN1; SMN2
SCHEMBL9625089 0.87 HDAC6 (0.37) LMNAL3MBTL1PTGS1PTGS2ALDH1A1
SCHEMBL9624134 0.84 L3MBTL1 (0.38) LMNAL3MBTL1PTGS1PTGS2ALDH1A1
SCHEMBL9625192 0.84 SMN1; SMN2 (0.37) LMNAL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL9624820 0.84 ALDH1A1 (0.42) LMNAALDH1A1SMN1; SMN2
SCHEMBL9625527 0.82 L3MBTL1 (0.38) LMNAL3MBTL1ALDH1A1POLBSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5116986-A HETEROAROMATIC AMINE DERIVATIVES DR. KARL THOMAE GMBH (DE) 1992-05-26 US disclosed
US-4912115-A Cardiovascular disorders DR. KARL THOMAE GMBH (DE) 1990-03-27 US disclosed