SCHEMBL5660735

SCHEMBL5660735

OC1CCCCN1c1ccc(Br)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.45
L3MBTL3 Q96JM7 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KMT2A Q03164 2/20 0.40
USP2 O75604 1/20 0.40
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
CCR1 P32246 1/20 0.35
CCR2 P41597 1/20 0.35
CHRNA7 P36544 1/20 0.35

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
SCHEMBL21262607 0.81 FFAR1 (0.43) L3MBTL3L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL10606613 0.81 MBTD1 (0.47) L3MBTL3L3MBTL1KMT2ASMN1; SMN2
SCHEMBL7328758 0.78 CHKA (0.48) HRH3L3MBTL1KMT2AUSP2MEN1
SCHEMBL22816347 0.78 MAOA (0.50) HRH3KMT2AHPGDMEN1ALDH1A1
SCHEMBL19859020 0.77 USP2 (0.49) L3MBTL3L3MBTL1KMT2AUSP2HPGD
SCHEMBL3174734 0.77 TYMP (0.46) HRH3CHRNA7
SCHEMBL22798963 0.76 BRS3 (0.44) HRH3L3MBTL3L3MBTL1KMT2AUSP2
SCHEMBL21163358 0.76 FFAR1 (0.48) HRH3L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL28868727 0.76 MAPT (0.42) L3MBTL3L3MBTL1KMT2AUSP2MEN1
SCHEMBL8502504 0.75 L3MBTL1 (0.44) L3MBTL3L3MBTL1KMT2AMEN1ALDH1A1

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-7176310-B1 Pyrimidinecarboxamide derivatives and their use as anti-inflammatory agents UCB SA (GB) 2007-02-13 US disclosed