SCHEMBL7871401

SCHEMBL7871401

FCCn1nnc(-c2ccc(CBr)cc2)n1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
LTA4H P09960 3/20 0.47
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP2D6 P10635 2/20 0.43
CYP2C9 P11712 2/20 0.43
KCNH2 Q12809 2/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL7873175 0.80 LTA4H (0.64) KMT2ALTA4HHPGDTSHRCYP2D6
SCHEMBL3541038 0.80 LMNA (0.65) KMT2AHPGDTSHRHSD17B10LMNA
SCHEMBL646758 0.78 RAB9A (0.46) KMT2ALTA4HHPGDTSHRHSD17B10
SCHEMBL9079405 0.71 AOC3 (0.47) KMT2AHPGDTSHRHSD17B10LMNA
SCHEMBL7019937 0.70 NPC1 (0.56) HPGDRAB9AL3MBTL1
SCHEMBL23828926 0.69 LTA4H (0.55) KMT2ALTA4HHPGDTSHRHSD17B10
SCHEMBL5091164 0.67 POLB (0.43) HPGDTSHRRAB9AL3MBTL1
SCHEMBL21959073 0.66 ALDH1A1 (0.43) KMT2AHPGDTSHRLMNARAB9A
SCHEMBL13232422 0.66 L3MBTL1 (0.59) KMT2AHPGDLMNARAB9AL3MBTL1
SCHEMBL23828911 0.66 LTA4H (0.58) KMT2ALTA4HHPGDTSHRHSD17B10

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
US-H2007-H1 INSECTICIDES FMC CORPORATION 2001-12-04 US disclosed
WO-1997026252-A1 INSECTICIDAL N-HETEROCYCLYLALKYL- OR N-[(POLYCYCLYL)-ALKYL]-N'-SUBSTITUTED PIPERAZINES FMC CORPORATION (US) 1997-07-24 WO disclosed