SCHEMBL11545893

SCHEMBL11545893

COc1cnn(-c2ccc(CBr)c(Cl)c2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.37
NPC1 O15118 4/20 0.37
MEN1 O00255 3/20 0.37
RAB9A P51151 3/20 0.37
NPBWR1 P48145 3/20 0.32
MCHR1 Q99705 3/20 0.32
P2RX7 Q99572 2/20 0.32
GHSR Q92847 1/20 0.32
MAPT P10636 3/20 0.32
RECQL P46063 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
ALDH1A1 P00352 3/20 0.31
MCL1 Q07820 1/20 0.31
S1PR4 O95977 1/20 0.30
S1PR1 P21453 1/20 0.30

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
SCHEMBL11550040 0.77 HTT (0.33) KMT2ANPC1MEN1RAB9AP2RX7
SCHEMBL11550998 0.77 NPC1 (0.40) KMT2ANPC1MEN1RAB9AGHSR
SCHEMBL11546359 0.76 KMT2A (0.40) KMT2ANPC1MEN1RAB9ANPBWR1
SCHEMBL2017241 0.71 NPBWR1 (0.37) KMT2ANPC1MEN1RAB9ANPBWR1
SCHEMBL11549493 0.71 BTK (0.31) MAPT
SCHEMBL11548596 0.70 ALDH1A1 (0.41) KMT2ANPC1MEN1RAB9ANPBWR1
SCHEMBL11485070 0.68 CYP3A4 (0.37) SMN1; SMN2ALDH1A1
SCHEMBL16797793 0.68 P2RX7 (0.49) KMT2ANPC1MEN1RAB9AP2RX7
SCHEMBL22899915 0.66 NPBWR1 (0.39) RAB9ANPBWR1MCHR1MAPTKDM4E
SCHEMBL11496226 0.66 KMT2A (0.39) KMT2AMEN1P2RX7HSD17B10ALDH1A1

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-4138552-A 4-(V-triazolyl)-styryl optical brighteners CIBA-GEIGY CORPORATION (US) 1979-02-06 US disclosed