SCHEMBL6927698

SCHEMBL6927698

Clc1nc2ccccc2c2c1nc(-c1ccccc1)n2CCN1CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
TSHR P16473 3/20 0.47
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAOB P27338 3/20 0.41
HTR6 P50406 3/20 0.41
ABCC1 P33527 1/20 0.40
HPGD P15428 6/20 0.39
KDM4E B2RXH2 5/20 0.39
CYP3A4 P08684 5/20 0.39
HSD17B10 Q99714 5/20 0.39
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
GAA P10253 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
LMNA P02545 1/20 0.38
RECQL P46063 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL6927398 0.92 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TSHRMEN1KMT2A
SCHEMBL6923907 0.86 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2TSHRMEN1KMT2A
SCHEMBL6838642 0.84 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2TSHRMEN1KMT2A
SCHEMBL6930115 0.83 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TSHRMEN1KMT2A
SCHEMBL6925914 0.83 NPY1R (0.44) ALDH1A1SMN1; SMN2MAOBHTR6LMNA
SCHEMBL6927074 0.82 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2TSHRMEN1KMT2A
Hydrochloric Acid SCHEMBL6923145 0.82 NPY1R (0.43) MAOBHTR6
SCHEMBL27570174 0.80 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2TSHRMEN1KMT2A
SCHEMBL6837641 0.78 EGFR (0.42) ALDH1A1SMN1; SMN2TSHRKMT2AMAOB
SCHEMBL6928651 0.78 SLC6A2 (0.39) ALDH1A1SMN1; SMN2TSHRKDM4ECYP3A4

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-6518265-B1 1H-imidazopyridine derivatives HOKURIKU SEIYAKU CO., LTD. (JP) 2003-02-11 US disclosed
EP-1104764-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2001-06-06 EP disclosed