SCHEMBL7568552

SCHEMBL7568552

NNc1cccc2c1-c1ccccc1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
L3MBTL1 Q9Y468 4/20 0.43
TDP1 Q9NUW8 3/20 0.43
POLB P06746 1/20 0.43
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
MAPT P10636 4/20 0.35
MAPK1 P28482 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
EGFR P00533 1/20 0.35
PABPC1 P11940 1/20 0.35
RAB9A P51151 1/20 0.35
LMNA P02545 4/20 0.35
CYP1A2 P05177 3/20 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
SCHEMBL4123519 0.83 MAPT (0.56) ALDH1A1L3MBTL1TDP1POLBCA12
SCHEMBL27129556 0.81 HEXA (0.39) ALDH1A1L3MBTL1TDP1POLBCA1
SCHEMBL6541790 0.80 CYP1A2 (0.43) ALDH1A1L3MBTL1TDP1POLBMAPT
SCHEMBL11817898 0.76 ALDH1A1 (0.46) ALDH1A1L3MBTL1TDP1POLBCA12
SCHEMBL10495494 0.76 MAPT (0.35) ALDH1A1L3MBTL1TDP1POLBMAPT
SCHEMBL5016493 0.76 ALDH1A1 (0.41) ALDH1A1L3MBTL1TDP1POLBCA12
SCHEMBL8204670 0.74 MAPT (0.57) ALDH1A1L3MBTL1TDP1POLBCA12
SCHEMBL3087928 0.74 MAPK1 (0.67) ALDH1A1L3MBTL1TDP1POLBMAPT
SCHEMBL6627649 0.73 HTR2B (0.43) ALDH1A1L3MBTL1TDP1POLBCA12
SCHEMBL4503147 0.73 L3MBTL1 (0.53) ALDH1A1L3MBTL1POLBMAPTMAPK1

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
EP-1233009-A2 Method for production of 4-substituted 2-alkylbiphenyls and 2-alcoxybiphenyls Clariant GmbH (DE) 2002-08-21 EP disclosed