SCHEMBL10909464

SCHEMBL10909464

CCN(CCCC(=O)Oc1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
KMT2A Q03164 7/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
EGFR P00533 1/20 0.42
ERBB2 P04626 1/20 0.42
MEN1 O00255 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
RECQL P46063 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL11212465 0.91 TDP1 (0.45) PRSS1PRSS2PRSS3KMT2ALMNA
SCHEMBL2498213 0.84 SMN1; SMN2 (0.60) KMT2AUSP2LMNAMEN1SMN1; SMN2
SCHEMBL6129317 0.81 LMNA (0.48) KMT2AUSP2LMNAMEN1SMN1; SMN2
SCHEMBL11672433 0.80 ALDH1A1 (0.41) KMT2AUSP2LMNAATMTDP1
SCHEMBL2070017 0.80 USP2 (0.41) KMT2AUSP2LMNAMEN1SMN1; SMN2
SCHEMBL11670563 0.79 MAOB (0.41) KMT2AUSP2LMNAATMTDP1
SCHEMBL1478896 0.78 PRSS1 (0.45) PRSS1PRSS2PRSS3KMT2ALMNA
SCHEMBL643462 0.77 KMT2A (0.63) PRSS1PRSS2PRSS3KMT2ALMNA
SCHEMBL2762361 0.77 SMN1; SMN2 (0.63) KMT2AMEN1SMN1; SMN2ALDH1A1ELANE
SCHEMBL44568 0.77 PRSS1 (0.62) PRSS1PRSS2PRSS3KMT2ALMNA

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-4564673-A 3-Cyano-5-nitrothiophene anilino monoazo dye for synthetic fibers RESEARCH ASSOCIATION OF SYNTHETIC DYESTUFFS (JP) 1986-01-14 US disclosed