SCHEMBL30083706

SCHEMBL30083706

Fc1cccc(F)c1CCNC(=S)Nc1ccc(Cl)cn1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTC4S Q16873 2/20 0.56
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
RAB9A P51151 9/20 0.49
NPC1 O15118 6/20 0.49
ALDH1A1 P00352 7/20 0.48
SMN1; SMN2 Q16637 6/20 0.48
LMNA P02545 2/20 0.48
PKM P14618 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.47
MAPT P10636 2/20 0.47
THRB P10828 1/20 0.44
HPGD P15428 1/20 0.44
CNR1 P21554 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TSHR P16473 1/20 0.43
ALOX12 P18054 1/20 0.43

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
SCHEMBL29355134 0.85 RAB9A (0.67) LTC4SKMT2AMEN1RAB9ANPC1
SCHEMBL6905477 0.85 ALDH1A1 (0.67) LTC4SKMT2AMEN1RAB9ANPC1
SCHEMBL6953648 0.81 ALDH1A1 (0.67) RAB9ANPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL2790373 0.80 KMT2A (0.55) LTC4SKMT2AMEN1RAB9ANPC1
SCHEMBL6907091 0.79 KMT2A (0.50) LTC4SKMT2AMEN1RAB9ANPC1
SCHEMBL14439883 0.79 ALDH1A1 (0.62) LTC4SKMT2AMEN1RAB9ANPC1
SCHEMBL6958381 0.79 ALDH1A1 (0.47) LTC4SKMT2ARAB9ANPC1ALDH1A1
SCHEMBL6953259 0.78 ALDH1A1 (0.60) KMT2ARAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL7018134 0.77 KMT2A (0.56) LTC4SKMT2AMEN1RAB9ANPC1
SCHEMBL2792582 0.74 ALDH1A1 (0.56) LTC4SKMT2AMEN1RAB9ANPC1

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-11505494-B2 Silicone coating suited for automotive windshields and process for preparation ROYAL BANK OF CANADA, AS ADMINISTRATIVE AGENT (CA) 2022-11-22 US disclosed