SCHEMBL6927074

SCHEMBL6927074

Clc1nc2ccccc2c2c1nc(-c1ccccc1)n2CCN1CCC2(CC1)OCCO2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.48
TSHR P16473 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP3A4 P08684 7/20 0.40
HSD17B10 Q99714 7/20 0.40
KDM4E B2RXH2 6/20 0.40
HPGD P15428 6/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 2/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
POLB P06746 1/20 0.38
ABCC1 P33527 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
ADORA2A P29274 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
SCHEMBL6927698 0.82 ALDH1A1 (0.47) ALDH1A1TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL6923907 0.81 ALDH1A1 (0.52) ALDH1A1TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL6930115 0.79 ALDH1A1 (0.44) ALDH1A1TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL27570174 0.76 ALDH1A1 (0.41) ALDH1A1TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL6927398 0.76 ALDH1A1 (0.44) ALDH1A1TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL6927222 0.74 ACKR3 (0.45) ALDH1A1TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL6928651 0.72 SLC6A2 (0.39) ALDH1A1TSHRSMN1; SMN2CYP3A4KDM4E
SCHEMBL10743391 0.70 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL6925914 0.70 NPY1R (0.44) ALDH1A1SMN1; SMN2
SCHEMBL10739020 0.70 TLR7 (0.55) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E

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