SCHEMBL27713626

SCHEMBL27713626

O=S(=O)(C[CH]C#Cc1ccccc1)N1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
TP53 P04637 1/20 0.47
ADAMTS4 O75173 4/20 0.45
MMP13 P45452 3/20 0.45
MMP14 P50281 3/20 0.45
CYP3A4 P08684 2/20 0.45
POLB P06746 1/20 0.44
NPC1 O15118 1/20 0.41
RAB9A P51151 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
SCHEMBL5507261 0.87 LMNA (0.43) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL16493578 0.86 LMNA (0.48) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL16493553 0.85 MAPT (0.53) LMNAMEN1KMT2AALDH1A1TP53
SCHEMBL16493548 0.84 ALDH1A1 (0.46) LMNAMEN1KMT2AALDH1A1ADAMTS4
SCHEMBL5507721 0.84 ALDH1A1 (0.45) LMNAMEN1KMT2AALDH1A1TP53
SCHEMBL5508114 0.81 MMP3 (0.42) ALDH1A1NPC1RAB9A
SCHEMBL4956015 0.81 KDM4E (0.47) LMNAMEN1KMT2AALDH1A1ADAMTS4
SCHEMBL4958220 0.80 ADAMTS4 (0.48) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL2156829 0.80 KMT2A (0.64) LMNAMEN1KMT2AALDH1A1HPGD
SCHEMBL2155489 0.80 KMT2A (0.64) LMNAMEN1KMT2AALDH1A1HPGD

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
CN-101124213-A Sulfonylamino cyclic derivatives and uses thereof SERONO LAB (CH) 2008-02-13 CN claimed
CN-101124213-A Sulfonylamino cyclic derivatives and uses thereof SERONO LAB (CH) 2008-02-13 CN disclosed