SCHEMBL7004715

SCHEMBL7004715

CC1(C)COC(c2ccccc2-c2ccc(COC3CCCCO3)cc2)=N1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 1/20 0.36
SELE P16581 1/20 0.36
HRH3 Q9Y5N1 4/20 0.35
CYP2D6 P10635 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
CREBBP Q92793 2/20 0.35
EP300 Q09472 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL7093547 0.97 HRH3 (0.36) ICAM1SELEHRH3CYP2D6KDM4C
SCHEMBL8958653 0.89 CREBBP (0.37) ICAM1SELEHRH3CYP2D6KDM4C
SCHEMBL8958413 0.86 HRH3 (0.34) ICAM1SELEHRH3CYP2D6KDM4C
SCHEMBL8873345 0.81 MEN1 (0.36) HRH3ALDH1A1
SCHEMBL7009255 0.78 HRH3 (0.40) HRH3CYP2D6KDM4EALDH1A1HTT
SCHEMBL7009195 0.78 HRH3 (0.42) HRH3CYP2D6KDM4EALDH1A1HTT
Hydrochloric Acid SCHEMBL9308089 0.78 HRH3 (0.42) HRH3CYP2D6CREBBPKDM4EALDH1A1
SCHEMBL7004285 0.78 HRH3 (0.42) HRH3CYP2D6KDM4EALDH1A1HTT
SCHEMBL7795519 0.76 ICAM1 (0.39) ICAM1SELEKDM4CCREBBPEP300
SCHEMBL11059345 0.74 GBA1 (0.40) ITGB1ITGA4

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0627433-B1 PROCESS FOR PRODUCING IMIDAZOPYRIDINE DERIVATIVE AND INTERMEDIATE EISAI CO LTD (JP) 2003-03-05 EP disclosed
US-5700938-A Intermediates for imidazopyridine derivatives EISAI CO., LTD. (JP) 1997-12-23 US disclosed
US-5618969-A Intermediates for imidazopyridines EISAI CO., LTD. (JP) 1997-04-08 US disclosed
US-5608068-A Process for the preparation of imidazopyridine derivatives and intermediates EISAI CO., LTD. (JP) 1997-03-04 US disclosed
US-5587504-A Sulfonyloxy-biphenylcarboxylic ester derivatives which are intermediates EISAI CO., LTD. (JP) 1996-12-24 US disclosed
US-5583229-A Process for the preparation of imidazopyridine derivatives EISAI CO., LTD. (JP) 1996-12-10 US disclosed
US-5559236-A Intermediates for substituted biphenylmethylmidazopyridine angiotensin II antagonists EISAI CO., LTD. (JP) 1996-09-24 US disclosed
US-5557002-A Process for the preparation of biphenyl containing intermediates useful in making angiotensin II receptor antagonists EISAI CO., LTD. (JP) 1996-09-17 US disclosed
US-5554757-A Process for the preparation of imidazopyridine derivatives, and intermediates therefore EISAI CO., LTD. (JP) 1996-09-10 US disclosed
EP-0627433-A1 PROCESS FOR PRODUCING IMIDAZOPYRIDINE DERIVATIVE AND INTERMEDIATE Eisai Co., Ltd. (JP) 1994-12-07 EP disclosed