SCHEMBL27802182

SCHEMBL27802182

CCCCOc1[c]c2ccc(Br)cc2cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
ATM Q13315 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MAPT P10636 2/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33

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
SCHEMBL27822845 0.82 CA12 (0.33) CA12CA1CA2CA3CA4
SCHEMBL27802204 0.79 MAPT (0.34) LMNASMN1; SMN2MEN1HTTKMT2A
SCHEMBL2256189 0.78 L3MBTL1 (0.41) SMN1; SMN2NPC1RAB9AL3MBTL1MAPT
SCHEMBL15564239 0.77 CYP2A6 (0.38) LMNASMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL2253966 0.77 LTA4H (0.41) SMN1; SMN2NPC1RAB9AL3MBTL1MAPT
SCHEMBL27802186 0.76 ERN1 (0.33) LMNAMEN1KMT2AL3MBTL1RXFP1
SCHEMBL1608519 0.75 CA12 (0.50) LMNAL3MBTL1MAPTCA12CA1
SCHEMBL30334792 0.75 CA12 (0.50) LMNAL3MBTL1MAPTCA12CA1
SCHEMBL27802206 0.75 MAOB (0.46) SMN1; SMN2HTTRAB9AMAPTTHRA
SCHEMBL27822870 0.75 LMNA (0.33) LMNASMN1; SMN2L3MBTL1ATMRXFP1

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
CN-101977883-A Process for production of 2-hydroxyaryl aldehyde compound NISSAN CHEMICAL IND LTD 2011-02-16 CN disclosed