SCHEMBL22299152

SCHEMBL22299152

O=C(CCCC1CCCCC1)Nc1ccc(NCc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.55
FFAR1 O14842 1/20 0.52
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
USP2 O75604 1/20 0.51
CYP3A4 P08684 1/20 0.51
ALOX15 P16050 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47
LDLR P01130 2/20 0.47
KLK7 P49862 1/20 0.45
MAPT P10636 1/20 0.45
ADAMTS4 O75173 1/20 0.45
ADAMTS5 Q9UNA0 1/20 0.45
NAMPT P43490 1/20 0.44
MCHR1 Q99705 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MTOR P42345 1/20 0.44

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
SCHEMBL22299151 0.86 KDM4E (0.59) RORCKMT2AMEN1USP2CYP3A4
SCHEMBL31577159 0.86 RORC (0.49) RORCFFAR1KMT2AMEN1USP2
SCHEMBL26623608 0.83 ALDH1A1 (0.64) RORCKMT2AMEN1USP2CYP3A4
SCHEMBL22299157 0.81 KCNQ2 (0.63) RORCKMT2AMEN1ALDH1A1LDLR
SCHEMBL31576851 0.81 KCNQ2 (0.63) RORCKMT2AMEN1ALDH1A1LDLR
SCHEMBL22288564 0.79 AAK1 (0.47) FFAR1KMT2AMEN1TDP1ALDH1A1
SCHEMBL31576995 0.79 AAK1 (0.47) FFAR1KMT2AMEN1TDP1ALDH1A1
SCHEMBL22298800 0.79 FFAR1 (0.56) RORCFFAR1NAMPTMCHR1MTOR
SCHEMBL22299252 0.79 FFAR1 (0.56) RORCFFAR1NAMPTMCHR1MTOR
SCHEMBL22298749 0.79 KCNQ3 (0.59) RORCFFAR1KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3917907-B1 MODULATORS OF POTASSIUM ION CHANNELS AND USES THEREOF UNIV DEGLI STUDI DI SALERNO (IT) 2025-05-21 EP claimed
EP-3917907-B1 MODULATORS OF POTASSIUM ION CHANNELS AND USES THEREOF UNIV DEGLI STUDI DI SALERNO (IT) 2025-05-21 EP disclosed
WO-2020157126-A1 MODULATORS OF POTASSIUM ION CHANNELS AND USES THEREOF Università degli Studi di Salerno (IT) 2020-08-06 WO disclosed