SCHEMBL9687046

SCHEMBL9687046

[CH2]c1c(C)cccc1NC(=O)OC(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
HPGD P15428 3/20 0.47
ALOX15 P16050 1/20 0.47
MAOB P27338 1/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NLRP3 Q96P20 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
TUBB4A P04350 2/20 0.40
TUBB P07437 2/20 0.40
TUBA3C P0DPH7 2/20 0.40
TUBA1B P68363 2/20 0.40
TUBA4A P68366 2/20 0.40
TUBB4B P68371 2/20 0.40

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
SCHEMBL5838522 0.87 NLRP3 (0.38) KDM4EHPGDALOX15NPC1RAB9A
SCHEMBL5839856 0.83 HPGD (0.49) KDM4EHPGDALOX15NPC1RAB9A
SCHEMBL11798134 0.83 NPC1 (0.58) KDM4EHPGDMAOBNPC1RAB9A
SCHEMBL7255889 0.80 HPGD (0.54) KDM4EHPGDALOX15MAOBNPC1
SCHEMBL9686207 0.79 ALDH1A1 (0.59) HPGDNPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL9686228 0.79 KDM4E (0.46) KDM4EHPGDALOX15MAOBNPC1
SCHEMBL3529435 0.79 KDM4E (0.46) KDM4EHPGDALOX15MAOBNPC1
SCHEMBL11660642 0.78 HPGD (0.53) KDM4EHPGDALOX15MAOBNPC1
SCHEMBL9685813 0.78 LCK (0.45) HPGDNPC1RAB9ANLRP3ALDH1A1
SCHEMBL9687657 0.78 HPGD (0.47) KDM4EHPGDALOX15MAOBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0268989-B1 IMIDAZOPYRIDINE COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-08 EP claimed
US-4831041-A ANTIULCER AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 US claimed
EP-0268989-A1 Imidazopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-06-01 EP claimed
EP-0268989-B1 IMIDAZOPYRIDINE COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-08 EP disclosed
US-4831041-A ANTIULCER AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 US disclosed
EP-0268989-A1 Imidazopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-06-01 EP disclosed